SCHEMBL9525178

SCHEMBL9525178

O=C(Nc1cccc(F)c1)Oc1nnc2ccccc2c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GLA P06280 2/20 0.42
MTOR P42345 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
MCL1 Q07820 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAOB P27338 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 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
SCHEMBL9524715 0.91 MEN1 (0.43) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL9524939 0.87 MEN1 (0.48) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL9524999 0.86 RAB9A (0.44) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL9525680 0.86 HTT (0.43) RAB9AKMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL9527660 0.86 ALDH1A1 (0.50) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL9527700 0.86 DDX3X (0.44) KDM4ESMN1; SMN2ALDH1A1MAPTCYP1A2
SCHEMBL9523908 0.86 HPGD (0.46) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL9525725 0.86 KMT2A (0.49) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL9524899 0.85 MAPT (0.50) RAB9AMEN1KMT2AKDM4EALDH1A1
SCHEMBL9524870 0.84 CSF1R (0.45) NPC1RAB9AKMT2AKDM4ESMN1; 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 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