SCHEMBL5324014

SCHEMBL5324014

Cc1csc(-c2ccccc2-c2[c]cccc2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.45
GLA P06280 1/20 0.41
CYP3A4 P08684 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP2E1 P05181 1/20 0.41
CYP2A6 P11509 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2B6 P20813 1/20 0.41
ADRA1A P35348 1/20 0.38
TGFBR1 P36897 2/20 0.38
ADORA2A P29274 4/20 0.36
GAA P10253 2/20 0.36
RAB9A P51151 2/20 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
SCHEMBL11126054 0.88 PDE10A (0.49) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL8313758 0.77 PDE10A (0.47) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL2761711 0.74 MEN1 (0.32) KMT2AKDM4EMEN1ALDH1A1MAPK1
SCHEMBL27287019 0.74 CYP3A4 (0.54) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL21091020 0.73 PDE10A (0.55) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL322239 0.72 MEN1 (0.35) KMT2AKDM4EMEN1ALDH1A1MAPK1
SCHEMBL8855149 0.72 MEN1 (0.35) KMT2AKDM4EMEN1ALDH1A1MAPK1
SCHEMBL5536800 0.72 PDE10A (0.53) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL829862 0.72 PDE10A (0.53) PDE10AGLACYP3A4KMT2AKDM4E
SCHEMBL13712985 0.71 PDE10A (0.49) PDE10AGLACYP3A4KMT2AKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO claimed
WO-2007135529-A2 AZABENZIMIDAZOLYL COMPOUNDS AS MGLUR2 POTENTIATORS PFIZER PRODUCTS INC. (US) 2007-11-29 WO claimed
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed