SCHEMBL12822201

SCHEMBL12822201

O=C(O)c1ccc2ncn(-c3ccccc3-c3ccccc3)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.67
ALDH1A1 P00352 4/20 0.55
HPGD P15428 4/20 0.55
LMNA P02545 2/20 0.55
HCAR1 Q9BXC0 1/20 0.52
RXRA P19793 1/20 0.44
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TBXA2R P21731 1/20 0.42
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PRSS1 P07477 1/20 0.42
THRB P10828 1/20 0.41
SRC P12931 1/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL16148147 0.82 HPGD (0.53) FGFR1ALDH1A1HPGDLMNARXRA
Hydrochloric Acid SCHEMBL7986276 0.79 FGFR1 (0.97) FGFR1ALDH1A1HPGDSRC
SCHEMBL12822182 0.79 FGFR1 (0.80) FGFR1HPGDTHRBSRC
SCHEMBL27995809 0.78 HTT (0.58) FGFR1ALDH1A1HPGDHCAR1KDM4E
SCHEMBL9638534 0.77 FGFR1 (0.59) FGFR1ALDH1A1HPGDLMNARXRA
SCHEMBL12822066 0.77 FGFR1 (0.47) FGFR1ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL12817507 0.76 FGFR1 (0.84) FGFR1HPGDTHRBSRC
SCHEMBL2076390 0.76 FGFR1 (0.70) FGFR1ALDH1A1HPGDLMNAKDM4E
SCHEMBL3734995 0.75 CXCR3 (0.52) FGFR1LMNASMN1; SMN2TBXA2RF2
SCHEMBL9637237 0.73 FGFR1 (0.58) FGFR1ALDH1A1HPGDLMNARXRA

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
WO-2012131501-A1 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AS COT KINASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-10-04 WO claimed
WO-2012131501-A1 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AS COT KINASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-10-04 WO disclosed