SCHEMBL7937098

SCHEMBL7937098

Cc1cc(C)c(-n2nc(C)c3c(Cl)c(C)c(C)nc32)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 1/20 0.46
CDK4 P11802 3/20 0.42
CCND1 P24385 3/20 0.42
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL8122423 0.81 CRHR1 (0.55) CRHR1KDM4EHPGDHSD17B10CDK4
SCHEMBL7928892 0.80 KDM4E (0.49) CRHR1KDM4EHPGDHSD17B10CDK4
SCHEMBL7961654 0.74 CRHR1 (0.54) CRHR1KDM4EHPGDCDK4CCND1
SCHEMBL7937119 0.74 CRHR1 (0.46) CRHR1KDM4EHPGDHSD17B10CDK4
SCHEMBL5620424 0.73 CRHR1 (0.47) CRHR1CDK4CCND1
SCHEMBL7935049 0.67 CRHR1 (0.47) CRHR1LMNA
SCHEMBL5826757 0.67 CDK4 (0.54) KDM4EHPGDHSD17B10CDK4CCND1
SCHEMBL7935053 0.66 ALDH1A1 (0.50) CRHR1KDM4EHPGDHSD17B10CDK4
SCHEMBL7354421 0.66 CRHR1 (0.54) CRHR1
SCHEMBL5599759 0.66 CRHR1 (0.87) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248753-B1 CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONISTS PFIZER INC 2001-06-19 US disclosed
EP-0765327-B1 PYRAZOLO AND PYRROLOPYRIDINES PFIZER (US) 1999-07-21 EP disclosed