SCHEMBL9524931

SCHEMBL9524931

O=C(NCc1ccc(F)cc1)Oc1nnc2ccccc2c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.44
PTGER4 P35408 2/20 0.43
RAB9A P51151 3/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 1/20 0.42
POLB P06746 3/20 0.42
NPC1 O15118 2/20 0.42
MAOB P27338 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
KDM4E B2RXH2 2/20 0.42
RECQL P46063 1/20 0.42
MCL1 Q07820 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL9524448 0.90 NCEH1 (0.46) RAB9ANPC1
SCHEMBL9524845 0.87 PLA2G2A (0.41) PTGER4RAB9AALDH1A1
SCHEMBL9524999 0.82 RAB9A (0.44) FAAHRAB9AALDH1A1SMN1; SMN2POLB
SCHEMBL9523698 0.79 RAB9A (0.49) RAB9AALDH1A1SMN1; SMN2NPC1KMT2A
SCHEMBL9523824 0.79 SMN1; SMN2 (0.53) PTGER4RAB9AALDH1A1SMN1; SMN2HTT
SCHEMBL9525182 0.78 GABRP (0.42) KMT2A
SCHEMBL9527439 0.78 SMN1; SMN2 (0.43) RAB9ASMN1; SMN2POLBNPC1LMNA
SCHEMBL9524773 0.77 NCEH1 (0.49) ALDH1A1
SCHEMBL9524784 0.76 TACR3 (0.46) RAB9AALDH1A1SMN1; SMN2NPC1KMT2A
SCHEMBL9524918 0.76 RAD52 (0.42) ALDH1A1SMN1; SMN2HTTKMT2AMEN1

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
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP claimed