SCHEMBL9080905

SCHEMBL9080905

CN(CCBr)Cc1c(C(F)(F)F)nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
CRHBP P24387 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHR2 Q13324 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CDK14 O94921 8/20 0.36
CCNY Q8ND76 8/20 0.36
TYK2 P29597 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CRHR1 P34998 1/20 0.34
GHSR Q92847 1/20 0.34
LMNA P02545 1/20 0.34
PTGES O14684 1/20 0.34

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
SCHEMBL9081731 0.93 MEN1 (0.39) MEN1CRHBPHTTKMT2ACRHR2
Hydrochloric Acid SCHEMBL9226626 0.92 MEN1 (0.39) MEN1CRHBPHTTKMT2ACRHR2
Hydrochloric Acid SCHEMBL9082095 0.90 PDCD1 (0.38) MEN1CRHBPHTTKMT2ACRHR2
SCHEMBL9230151 0.89 CDK14 (0.41) MEN1CRHBPHTTKMT2ACRHR2
SCHEMBL9079941 0.89 MEN1 (0.42) MEN1CRHBPHTTKMT2ACRHR2
SCHEMBL9081490 0.88 MEN1 (0.38) MEN1CRHBPHTTKMT2ACRHR2
SCHEMBL9079750 0.87 MEN1 (0.38) MEN1CRHBPHTTKMT2ACRHR2
SCHEMBL9283353 0.86 KMT2A (0.43) MEN1CRHBPHTTKMT2ACRHR2
Hydrochloric Acid SCHEMBL9081112 0.85 MEN1 (0.39) MEN1CRHBPHTTKMT2ACRHR2
Hydrochloric Acid SCHEMBL9082419 0.85 CRHR1 (0.49) MEN1KMT2ACYP1A2CYP3A4CYP2C9

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
WO-1996034866-A1 IMIDAZO 1,2-A PYRIDINE AND IMIDAZO 1,2-A PYRIDEZINE DERIVATIVES AND THEIR USE AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-07 WO disclosed