SCHEMBL4770175

SCHEMBL4770175

O=Cc1c(-c2ccccc2)nc2n1CCS2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
KDM4E B2RXH2 5/20 0.59
FLT1 P17948 1/20 0.58
KDR P35968 1/20 0.58
TEK Q02763 1/20 0.58
MAPT P10636 7/20 0.58
ALDH1A1 P00352 4/20 0.58
NPSR1 Q6W5P4 4/20 0.58
GAA P10253 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
MAPK1 P28482 2/20 0.58
CYP2C19 P33261 3/20 0.56
CYP1A2 P05177 2/20 0.56
HPGD P15428 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 1/20 0.54
CYP2C9 P11712 2/20 0.44
TP53 P04637 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15114825 0.86 MEN1 (0.60) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL9744026 0.80 MAPT (0.58) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL11403139 0.78 MAPK14 (0.63) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL12991482 0.77 MEN1 (0.58) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL9743602 0.77 MAPT (0.58) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL4764648 0.74 TEK (1.00) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL4764646 0.74 TEK (1.00) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL18884070 0.73 MEN1 (0.54) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL20078217 0.73 ALDH1A1 (0.54) MEN1KMT2AKDM4EFLT1KDR
SCHEMBL18878417 0.73 MAPT (0.54) MEN1KMT2AKDM4EFLT1KDR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-10-27 US disclosed
US-10676484-B2 Compositions and methods for treating leukemia DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-06-09 US disclosed
US-20200148702-A1 COMPOSITIONS AND METHODS FOR TREATING NEOPLASIA, INFLAMMATORY DISEASE AND OTHER DISORDERS DANA FARBER CANCER INST INC (US) 2020-05-14 US disclosed
US-10407441-B2 Compositions and methods for treating neoplasia, inflammatory disease and other disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-09-10 US disclosed
US-20180222917-A1 COMPOSITIONS AND METHODS FOR TREATING LEUKEMIA COLD SPRING HARBOR LABORATORY 2018-08-09 US disclosed
US-20180222917-A1 COMPOSITIONS AND METHODS FOR TREATING LEUKEMIA COLD SPRING HARBOR LABORATORY 2018-08-09 US disclosed
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-12-21 US disclosed
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-12-21 US disclosed
US-9846160-B2 Ganglioside GD2 as a marker and target on cancer stem cells BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEMS (US) 2017-12-19 US disclosed
US-9846160-B2 Ganglioside GD2 as a marker and target on cancer stem cells BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEMS (US) 2017-12-19 US disclosed
US-20130252331-A1 COMPOSITIONS AND METHODS FOR MODULATING METABOLISM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-09-26 US disclosed
US-20130252331-A1 COMPOSITIONS AND METHODS FOR MODULATING METABOLISM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-09-26 US disclosed
WO-2013130603-A1 GANGLIOSIDE GD2 AS A MARKER AND TARGET ON CANCER STEM CELLS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-09-06 WO disclosed
US-20130210813-A1 Male Contraceptive Compositions and Methods of Use DANA-FARBER CANCER INSTITUTE, INC. 2013-08-15 US disclosed
US-20130210813-A1 Male Contraceptive Compositions and Methods of Use DANA-FARBER CANCER INSTITUTE, INC. 2013-08-15 US disclosed
US-20130184264-A1 Compositions And Methods For Treating Neoplasia, Inflammatory Disease And Other Disorders NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-07-18 US disclosed
EP-1575963-B1 ANTI-ANGIOGENETIC THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-05-07 EP disclosed
US-20060069109-A1 Therapeutic agents ASTRAZENECA AB (SE) 2006-03-30 US disclosed
EP-1575963-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2005-09-21 EP disclosed
WO-2004058776-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy BRDT, BRD4, BRD1 MEN1 4108/4885KMT2A 415/4885KDM4E 1552/4885
US-10407441-B2 Compositions and methods for treating neoplasia, inflammatory disease and other disorders BRPF3, EP300, BRD3 MEN1 1913/4885KMT2A 134/4885KDM4E 317/4885
US-10676484-B2 Compositions and methods for treating leukemia MCL1, ABL1, FLT3 MEN1 2413/4885KMT2A 231/4885KDM4E 1909/4885
US-20130210813-A1 Male Contraceptive Compositions and Methods of Use SHBG, CYP19A1, CYP17A1 MEN1 389/4885KMT2A 2696/4885KDM4E 903/4885
US-20060069109-A1 Therapeutic agents TIE1, TEK, KDR MEN1 242/4885KMT2A 1034/4885KDM4E 2006/4885
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY BRDT, BRD4, BRD1 MEN1 4108/4885KMT2A 415/4885KDM4E 1552/4885
US-20180222917-A1 COMPOSITIONS AND METHODS FOR TREATING LEUKEMIA MCL1, ABL1, FLT3 MEN1 2413/4885KMT2A 231/4885KDM4E 1909/4885
US-20130184264-A1 Compositions And Methods For Treating Neoplasia, Inflammatory Disease And Other Disorders BRPF3, EP300, BRD3 MEN1 1913/4885KMT2A 134/4885KDM4E 317/4885
US-20130252331-A1 COMPOSITIONS AND METHODS FOR MODULATING METABOLISM BRD3, BRD2, BRD4 MEN1 4189/4885KMT2A 599/4885KDM4E 1108/4885
US-20200148702-A1 COMPOSITIONS AND METHODS FOR TREATING NEOPLASIA, INFLAMMATORY DISEASE AND OTHER DISORDERS BRPF3, EP300, BRD3 MEN1 1913/4885KMT2A 134/4885KDM4E 317/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.