SCHEMBL8076484

SCHEMBL8076484

N#Cc1c(-c2ccccc2)c(-c2ccccc2)n(Cc2ccccc2)c1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.50
ALDH1A1 P00352 6/20 0.48
LMNA P02545 4/20 0.48
KDM4E B2RXH2 4/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 2/20 0.46
RXFP1 Q9HBX9 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
PDE9A O76083 1/20 0.44
PDE1C Q14123 1/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 2/20 0.42
GLA P06280 1/20 0.42
CNR1 P21554 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL3060767 0.89 HPGD (0.55) ARALDH1A1LMNAKDM4EHPGD
SCHEMBL3052703 0.89 HPGD (0.55) ARALDH1A1LMNAKDM4EHPGD
SCHEMBL27440350 0.87 ALDH1A1 (0.55) ARALDH1A1LMNAKDM4EHPGD
SCHEMBL29961535 0.87 ALDH1A1 (0.40) ARALDH1A1LMNAKDM4EHPGD
SCHEMBL15018232 0.86 ALDH1A1 (0.49) ARALDH1A1LMNAKDM4EHPGD
SCHEMBL4854571 0.80 ALDH1A1 (0.49) ALDH1A1LMNAKDM4EHPGDSMN1; SMN2
SCHEMBL27440039 0.78 NAMPT (0.43) ARALDH1A1LMNATSHRKMT2A
SCHEMBL15018977 0.77 AR (0.48) ARALDH1A1LMNASMN1; SMN2TSHR
SCHEMBL14193672 0.75 ALDH1A1 (0.76) ALDH1A1LMNAKDM4EHPGDSMN1; SMN2
SCHEMBL27888661 0.75 ALDH1A1 (0.49) ARALDH1A1LMNAKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2791142-B1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS US HEALTH (US) 2019-07-03 EP disclosed
EP-2791142-B1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS US HEALTH (US) 2019-07-03 EP disclosed
US-10301314-B2 Compounds and methods for the prevention and treatment of tumor metastasis and tumorigenesis THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2019-05-28 US disclosed
US-10301314-B2 Compounds and methods for the prevention and treatment of tumor metastasis and tumorigenesis THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2019-05-28 US disclosed
US-9877966-B1 Combination therapy for the inhibition of metastasis and tumorigenesis OLIVA EUGENE J (US) 2018-01-30 US disclosed
US-9877966-B1 Combination therapy for the inhibition of metastasis and tumorigenesis OLIVA EUGENE J (US) 2018-01-30 US disclosed
US-9877966-B1 Combination therapy for the inhibition of metastasis and tumorigenesis OLIVA EUGENE J (US) 2018-01-30 US disclosed
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT OF HEALTH AND HUMAN SERVICES (US) 2017-09-14 US disclosed
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT OF HEALTH AND HUMAN SERVICES (US) 2017-09-14 US disclosed
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT OF HEALTH AND HUMAN SERVICES (US) 2017-09-14 US disclosed
US-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS NORTHWESTERN UNIVERSITY 2014-10-30 US disclosed
US-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS NORTHWESTERN UNIVERSITY 2014-10-30 US disclosed
US-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS NORTHWESTERN UNIVERSITY 2014-10-30 US disclosed
EP-2791142-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS The U.S.A. as represented by the Secretary, Department of Health and Human Services (US) 2014-10-22 EP disclosed
WO-2013090912-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-06-20 WO disclosed
WO-2013090912-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-06-20 WO disclosed
US-6096749-A ANTITUMOR, EPIDERMAL GROWTH FACTOR NOVARTIS CORPORATION (US) 2000-08-01 US disclosed
US-5686457-A FOR TREATING A TUMOR OR PSORIASIS NOVARTIS CORPORATION (US) 1997-11-11 US disclosed
EP-0682027-B1 Pyrrolopyrimidine derivatives with antiproliferative action CIBA GEIGY AG (CH) 1997-10-15 EP disclosed
EP-0682027-A1 Pyrrolopyrimidine derivatives with antiproliferative action CIBA-GEIGY AG (CH) 1995-11-15 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-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS PGF, BRCA1, RB1 AR 334/4885ALDH1A1 192/4885LMNA 424/4885
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS PGF, BRCA1, RB1 AR 334/4885ALDH1A1 192/4885LMNA 424/4885
US-10301314-B2 Compounds and methods for the prevention and treatment of tumor metastasis and tumorigenesis PGF, BRCA1, RB1 AR 334/4885ALDH1A1 192/4885LMNA 424/4885

“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.