SCHEMBL4750235

SCHEMBL4750235

Cc1nc(-c2ccc(F)cc2)cc2cc[nH]c(=O)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.43
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CASP3 P42574 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MAPK1 P28482 2/20 0.38
JAK2 O60674 4/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
RET P07949 2/20 0.38
KDR P35968 2/20 0.38
MAPT P10636 1/20 0.38
PSD A5PKW4 2/20 0.38
PIM1 P11309 2/20 0.37
CLK4 Q9HAZ1 2/20 0.37
CDC7 O00311 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
SCHEMBL4750230 0.87 CYP1A2 (0.38) ALDH1A1ZAP70CHEK1
SCHEMBL4246806 0.85 ZAP70 (0.48) RAD51NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4750216 0.77 GRIA1 (0.40) NPC1RAB9AMAPK1JAK2ALDH1A1
SCHEMBL4243560 0.75 CHEK1 (0.41) RAB9ASMN1; SMN2JAK2ALDH1A1CHEK1
SCHEMBL4747830 0.73 RAD51 (0.42) RAD51NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL12848802 0.72 CHEK1 (0.46) RAB9ASMN1; SMN2JAK2ALDH1A1CHEK1
SCHEMBL4750620 0.71 RAD51 (0.40) RAD51NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL5816274 0.70 ALDH1A1 (0.43) RAD51NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL4750005 0.69 RAD51 (0.39) RAD51NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL4750212 0.68 PSD (0.42) RAD51NPC1RAB9ACASP3SMN1; SMN2

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
WO-2008123755-A1 A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTAM TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA SK CHEMICALS CO., LTD. (KR) 2008-10-16 WO claimed
WO-2006112666-A1 PYRIDINE DERIVATIVES, METHODS OF THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2006-10-26 WO claimed
WO-2008123755-A1 A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTAM TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA SK CHEMICALS CO., LTD. (KR) 2008-10-16 WO disclosed
WO-2006112666-A1 PYRIDINE DERIVATIVES, METHODS OF THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2006-10-26 WO disclosed