SCHEMBL7969289

SCHEMBL7969289

Oc1c(-c2ccc(-c3cccnc3)cc2)n[nH]c1-c1nc2cc3c(cc2[nH]1)CNC3

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.48
F10 P00742 1/20 0.48
F11 P03951 1/20 0.48
F7 P08709 1/20 0.48
MAPT P10636 2/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
STAT1 P42224 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RET P07949 1/20 0.43
CLK2 P49760 6/20 0.42
CLK3 P49761 6/20 0.42
DYRK1A Q13627 6/20 0.42
DGAT1 O75907 1/20 0.41
KCNH2 Q12809 1/20 0.41
WNT1 P04628 3/20 0.41
GUSB P08236 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
SCHEMBL7977818 0.85 F9 (0.48) F9F10F11F7MAPT
SCHEMBL7975112 0.84 F9 (0.47) F9F10F11F7MAPT
SCHEMBL16258933 0.84 F9 (0.47) F9F10F11F7MAPT
SCHEMBL7969287 0.84 F9 (0.46) F9F10F11F7MAPT
SCHEMBL7960905 0.81 F9 (0.46) F9F10F11F7
SCHEMBL7972949 0.81 F9 (0.46) F9F10F11F7
SCHEMBL7969756 0.81 F10 (0.42) F9F10F11F7KDM4E
SCHEMBL10140046 0.80 KDM4E (0.43) MAPTKDM4EALDH1A1HPGDRAB9A
SCHEMBL7973330 0.80 F9 (0.44) F9F10F11F7KDM4E
SCHEMBL7973518 0.78 F9 (0.43) F9F10F11F7MAPT

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
WO-2009143039-A2 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS SCHERING CORPORATION (US) 2009-11-26 WO disclosed