SCHEMBL25544641

SCHEMBL25544641

CCC(C)(CC)c1ccc(-c2ccc(N3C(=O)C4C(C3=O)C3C(=O)N(C(C)(CC)CC)C(=O)C43)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.37
AR P10275 11/20 0.33
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ROCK2 O75116 3/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL21090633 0.95 CRHR1 (0.35) CRHR1ARATM
SCHEMBL13078214 0.95 CRHR1 (0.35) CRHR1ARATM
SCHEMBL25544602 0.85 CRHR1 (0.36) CRHR1AR
SCHEMBL21215699 0.81 KMT2A (0.35) ATML3MBTL1TSHR
SCHEMBL14045733 0.80 CA9 (0.35) CRHR1ARTSHRCYP2C19NPSR1
SCHEMBL13515115 0.79 CA9 (0.36) CRHR1ARTSHRNPSR1
SCHEMBL14045642 0.78 BRD4 (0.39) NPSR1
SCHEMBL21215977 0.78 KMT2A (0.33) TSHR
SCHEMBL14045641 0.77 CA9 (0.41) CRHR1AR
SCHEMBL14045732 0.77 CA9 (0.42) TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230173800-A1 MULTILAYER BODY COMPRISING HIGHLY HEAT-RESISTANT TRANSPARENT FILM TOYOBO CO., LTD. (JP) 2023-06-08 US disclosed