SCHEMBL311465

SCHEMBL311465

CC(C)(C)C(=O)Nc1nc(Cl)c2cc[nH]c2n1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ADORA1 P30542 3/20 0.43
PDGFRB P09619 1/20 0.41
KDR P35968 5/20 0.41
EGFR P00533 3/20 0.41
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
JAK1 P23458 3/20 0.38
F2 P00734 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
XBP1 P17861 1/20 0.36
ADORA2A P29274 2/20 0.36
RAB9A P51151 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL10178075 0.86 JAK1 (0.37) ADORA1PDGFRBKDRJAK1MAPT
SCHEMBL3801893 0.84 ADORA1 (0.44) MEN1KMT2AADORA1PDGFRBKDR
SCHEMBL13663989 0.80 ADORA1 (0.43) ADORA1JAK1HSD17B10ALDH1A1ADORA2A
SCHEMBL9451618 0.77 ADORA2A (0.37) ADORA1PDGFRBKDRJAK1KDM4E
SCHEMBL27176130 0.76 MEN1 (0.43) MEN1KMT2AADORA1PDGFRBKDR
SCHEMBL30083280 0.76 MEN1 (0.43) MEN1KMT2AADORA1PDGFRBKDR
SCHEMBL16743055 0.75 TYRO3 (0.40) ADORA1KDRADORA2A
SCHEMBL10652298 0.74 JAK2 (0.46) ADORA1POLBL3MBTL1JAK1ALDH1A1
SCHEMBL22476359 0.74 ADORA1 (0.56) MEN1KMT2AADORA1PDGFRBKDR
SCHEMBL8907430 0.74 AXL (0.34) ADORA1KDRADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117229281-A Di-parallel ring derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-15 CN disclosed
WO-2023168830-A1 HEMTAC SMALL MOLECULE DEGRADATION AGENT AND USE THEREOF 山东大学 2023-09-14 WO disclosed
EP-3515923-A1 PRODRUGS OF FLUORINATED ACYCLIC NUCLEOSIDE PHOSPHONATES Katholieke Universiteit Leuven (BE) 2019-07-31 EP disclosed
WO-2018055071-A1 PRODRUGS OF FLUORINATED ACYCLIC NUCLEOSIDE PHOSPHONATES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2018-03-29 WO disclosed
WO-2018055071-A1 PRODRUGS OF FLUORINATED ACYCLIC NUCLEOSIDE PHOSPHONATES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2018-03-29 WO disclosed
US-9862983-B1 Recombinase-based amplification with substitute nucleotides BENNER STEVEN (US) 2018-01-09 US disclosed
US-9637783-B1 Amplification of oligonucleotides containing non-standard nucleotides by polymerase chain reactions DEFENSE THREAT REDUCTION AGENCY; DEPT. OF DEFENSE, UNITED STATES GOVERNMENT 2017-05-02 US disclosed
CN-102971335-B Reversibly terminating primer extension reagents 史蒂芬·阿尔伯特·本纳 2016-06-29 CN disclosed
WO-2014124430-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2014-08-14 WO disclosed
CN-102971335-A Reversibly terminating primer extension reagents BENNER STEVEN ALBERT 2013-03-13 CN disclosed
EP-1869027-A2 ALKYNYL PYRROLOPYRIMIDINES AND RELATED ANALOGS AS HSP90-INHIBITORS Conforma Therapeutics Corporation (US) 2007-12-26 EP disclosed
US-20070173483-A1 Pyrrolopyrimidines and Related Analogs as HSP90-Inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2007-07-26 US disclosed
US-7138402-B2 Pyrrolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2006-11-21 US disclosed
US-20060223797-A1 ALKYNYL PYRROLOPYRIMIDINES AND RELATED ANALOGS AS HSP90-INHIBITORS CONFORMA THERAPEUTICS CORPORATION 2006-10-05 US disclosed
WO-2006105372-A2 ALKYNYL PYRROLOPYRIMIDINES AND RELATED ANALOGS AS HSP90-INHIBITORS CONFORMA THERAPEUTICS CORPORATION (US) 2006-10-05 WO disclosed
EP-1670802-A2 NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS Conforma Therapeutic Corporation (US) 2006-06-21 EP disclosed
US-20050107343-A1 Pyrrolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION 2005-05-19 US disclosed
WO-2005028434-A2 NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS CONFORMA THERAPEUTICS CORPORATION (US) 2005-03-31 WO disclosed
US-6093807-A Sugar-modified 7-deaza-7-substituted oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2000-07-25 US disclosed
EP-0567223-A1 Glutamic acid derivatives as antineoplastic agents ELI LILLY AND COMPANY (US) 1993-10-27 EP 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 (3 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-20050107343-A1 Pyrrolopyrimidines and related analogs as HSP90-inhibitors HSP90AB2P, HSP90AB1, HSP90AA1 MEN1 4106/4885KMT2A 3946/4885ADORA1 4814/4885
US-20060223797-A1 ALKYNYL PYRROLOPYRIMIDINES AND RELATED ANALOGS AS HSP90-INHIBITORS HSP90AB2P, HSP90AB1, HSP90AA1 MEN1 4789/4885KMT2A 4204/4885ADORA1 4689/4885
US-20070173483-A1 Pyrrolopyrimidines and Related Analogs as HSP90-Inhibitors HSP90AB2P, HSP90AB1, HSP90AA1 MEN1 4106/4885KMT2A 3946/4885ADORA1 4814/4885

“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.