SCHEMBL9587348

SCHEMBL9587348

C/C(=C\Cc1ccccc1F)c1ccncc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
MAOB P27338 1/20 0.36
ROCK1 Q13464 3/20 0.36
PRKACA P17612 2/20 0.36
CDC7 O00311 1/20 0.36
PLK4 O00444 1/20 0.36
CHEK1 O14757 1/20 0.36
DAPK3 O43293 1/20 0.36
RPS6KA5 O75582 1/20 0.36
MAP4K4 O95819 1/20 0.36
CHEK2 O96017 1/20 0.36
PIM1 P11309 1/20 0.36
RPS6KB1 P23443 1/20 0.36
AKT1 P31749 1/20 0.36
AKT2 P31751 1/20 0.36
FLT4 P35916 1/20 0.36
PRKCI P41743 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
RPS6KA3 P51812 1/20 0.36

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
SCHEMBL9586883 1.00 RAB9A (0.39) RAB9AMAOBROCK1PRKACACDC7
SCHEMBL9586885 1.00 RAB9A (0.39) RAB9AMAOBROCK1PRKACACDC7
SCHEMBL9588478 0.77 GPR52 (0.43) RAB9AMAOBHPGDPLOD2PLOD3
SCHEMBL9588484 0.77 GPR52 (0.43) RAB9AMAOBHPGDPLOD2PLOD3
SCHEMBL9588485 0.77 GPR52 (0.43) RAB9AMAOBHPGDPLOD2PLOD3
SCHEMBL28250552 0.76 AKR1C3 (0.44) MAOBRPS6KA3TAAR1HPGDALDH1A1
SCHEMBL14604992 0.71 TAAR1 (0.39) MAOBTAAR1ALDH1A1LMNA
SCHEMBL18899058 0.71 NAMPT (0.43) ROCK1PRKACACDC7PLK4CHEK1
SCHEMBL20708210 0.70 L3MBTL1 (0.39) HPGDPLOD2PLOD3ALDH1A1CYP1A2
SCHEMBL3282677 0.69 ALDH1A1 (0.53) RAB9AROCK1PRKACACDC7PLK4

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-5262420-A Phenylalkylpyridines IDEMITSU KOSAN CO., LTD. (JP) 1993-11-16 US disclosed
EP-0383950-A1 PYRIDINE DERIVATIVES AND INSECTICIDAL AND MITICIDAL AGENT CONTAINING SAME AS ACTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-08-29 EP disclosed