SCHEMBL17107302

SCHEMBL17107302

CNC(=O)c1ccc(N2C(=S)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)C23CCCCC3)cc1F

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 20/20 0.85
GABRP O00591 2/20 0.78
GABRD O14764 2/20 0.78
GABRA1 P14867 2/20 0.78
GABRB1 P18505 2/20 0.78
GABRG2 P18507 2/20 0.78
GABRB3 P28472 2/20 0.78
GABRA5 P31644 2/20 0.78
GABRA3 P34903 2/20 0.78
GABRA2 P47869 2/20 0.78
GABRB2 P47870 2/20 0.78
GABRA4 P48169 2/20 0.78
GABRE P78334 2/20 0.78
GABRA6 Q16445 2/20 0.78
GABRG1 Q8N1C3 2/20 0.78
GABRG3 Q99928 2/20 0.78
GABRQ Q9UN88 2/20 0.78
NR3C1 P04150 2/20 0.78
NR1I2 O75469 1/20 0.78
PGR P06401 1/20 0.78

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
SCHEMBL15661295 1.00 AR (0.85) ARGABRPGABRDGABRA1GABRB1
SCHEMBL547539 0.99 AR (0.87) ARGABRPGABRDGABRA1GABRB1
SCHEMBL29861461 0.99 AR (0.87) ARGABRPGABRDGABRA1GABRB1
SCHEMBL547156 0.98 AR (0.87) ARGABRPGABRDGABRA1GABRB1
SCHEMBL29378261 0.98 AR (0.87) ARGABRPGABRDGABRA1GABRB1
SCHEMBL17107295 0.94 AR (0.85) ARGABRPGABRDGABRA1GABRB1
SCHEMBL17117368 0.92 AR (0.78) ARGABRPGABRDGABRA1GABRB1
SCHEMBL17107300 0.92 AR (0.78) ARGABRPGABRDGABRA1GABRB1
SCHEMBL17117389 0.92 AR (0.78) ARGABRPGABRDGABRA1GABRB1
SCHEMBL14930979 0.92 AR (1.00) ARGABRPGABRDGABRA1GABRB1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739069-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2023-08-29 US disclosed
US-11739069-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2023-08-29 US disclosed
EP-2911666-B1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-08-24 EP disclosed
US-20200172504-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2020-06-04 US disclosed
US-20200172504-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2020-06-04 US disclosed
US-10450294-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2019-10-22 US disclosed
US-10450294-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2019-10-22 US disclosed
EP-2912194-B1 ANDROGEN RECEPTOR VARIANTS AND METHODS FOR MAKING AND USING MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2019-05-08 EP disclosed
US-10206911-B2 Androgen receptor variants and methods for making and using MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2019-02-19 US disclosed
US-20170320849-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2017-11-09 US disclosed
US-20170320849-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2017-11-09 US disclosed
US-9650359-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2017-05-16 US disclosed
US-9650359-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2017-05-16 US disclosed
US-20160257666-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2016-09-08 US disclosed
US-20160257666-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR MEMORIAL SLOAN-KETTERING CANCER CENTER 2016-09-08 US disclosed
US-9365542-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2016-06-14 US disclosed
US-9365542-B2 Modulators of resistant androgen receptor MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2016-06-14 US disclosed
US-20150274693-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-01 US disclosed
US-20150274693-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-01 US disclosed
US-20150265587-A1 ANDROGEN RECEPTOR VARIANTS AND METHODS FOR MAKING AND USING MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2015-09-24 US 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 (8 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-20150265587-A1 ANDROGEN RECEPTOR VARIANTS AND METHODS FOR MAKING AND USING AR, NR5A1, NR3C2 AR 1/4885GABRP 2507/4885GABRD 2427/4885
US-10206911-B2 Androgen receptor variants and methods for making and using AR, NR5A1, NR3C2 AR 1/4885GABRP 2507/4885GABRD 2427/4885
US-11739069-B2 Modulators of resistant androgen receptor AR, NR5A1, ESRRA AR 1/4885GABRP 256/4885GABRD 179/4885
US-20160257666-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR AR, NR5A1, ESRRA AR 1/4885GABRP 256/4885GABRD 179/4885
US-20200172504-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR AR, NR5A1, ESRRA AR 1/4885GABRP 256/4885GABRD 179/4885
US-20170320849-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR AR, NR5A1, ESRRA AR 1/4885GABRP 256/4885GABRD 179/4885
US-20150274693-A1 MODULATORS OF RESISTANT ANDROGEN RECEPTOR AR, NR5A1, ESRRA AR 1/4885GABRP 396/4885GABRD 298/4885
US-10450294-B2 Modulators of resistant androgen receptor AR, NR5A1, ESRRA AR 1/4885GABRP 256/4885GABRD 179/4885

“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.