SCHEMBL27717543

SCHEMBL27717543

Clc1ccncc1.O=CCl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.46
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HSD17B10 Q99714 1/20 0.42
GCGR P47871 1/20 0.41
NT5E P21589 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
CDC25B P30305 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
FLT3 P36888 1/20 0.37
GAA P10253 1/20 0.37
CYP2A6 P11509 1/20 0.37
POLB P06746 1/20 0.37
FFAR2 O15552 1/20 0.37

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
Hydrochloric Acid SCHEMBL27759768 0.97 CYP19A1 (0.44) CYP19A1KMT2AMEN1HSD17B10GCGR
Formamide SCHEMBL27704471 0.89 CYP19A1 (0.46) CYP19A1KMT2AMEN1HSD17B10GCGR
Formic Acid SCHEMBL27456543 0.86 KMT2A (0.47) CYP19A1KMT2AMEN1HSD17B10GCGR
SCHEMBL14690989 0.85
SCHEMBL6842 0.85
SCHEMBL4735385 0.85 CYP19A1 (0.57) CYP19A1KMT2AMEN1GCGRNT5E
Formic Acid SCHEMBL27691334 0.84 KMT2A (0.45) CYP19A1KMT2AMEN1HSD17B10GCGR
Formaldehyde SCHEMBL27738996 0.82
Hydrochloric Acid SCHEMBL25275623 0.82
SCHEMBL29843433 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101432281-B 6-0-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG 2013-08-28 CN disclosed
CN-101273009-B Insecticidal 3-acylaminobenzanilides BAYER CROPSCIENCE AG 2012-09-05 CN disclosed
CN-101432281-A 6-O-substituted benzoxazole and benzothiazole compounds and methods for inhibiting CSF-1R signaling NOVARTIS AG (CH) 2009-05-13 CN disclosed
CN-101273009-A Insecticidal 3-acylaminobenzanilides BAYER CROPSCIENCE AG (DE) 2008-09-24 CN disclosed