SCHEMBL5323085

SCHEMBL5323085

Cc1[c]c(-c2nc3ccccc3s2)ccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.49
▸ KDM4E B2RXH2 8/20 0.49
▸ NPC1 O15118 7/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ MAPT P10636 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ L3MBTL1 Q9Y468 4/20 0.49
▸ TDP1 Q9NUW8 3/20 0.49
▸ GAA P10253 3/20 0.49
▸ HPGD P15428 1/20 0.48
▸ ILK Q13418 1/20 0.47
▸ TP53 P04637 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ NFKB1 P19838 3/20 0.46
▸ NFKB2 Q00653 3/20 0.46
▸ RELA Q04206 3/20 0.46
▸ APP P05067 3/20 0.45

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
SCHEMBL29117998 0.81 RAB9A (0.46) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL713163 0.75 RAB9A (0.50) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL827403 0.74 RAB9A (0.67) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL5323730 0.73 RAB9A (0.47) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL28115653 0.73 ILK (0.60) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
Hydrogen Sulfide SCHEMBL28205214 0.72 RAB9A (0.64) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
Hydrogen Sulfide SCHEMBL16859912 0.72 RAB9A (0.64) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
Methane SCHEMBL28056221 0.72 RAB9A (0.64) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL15987517 0.72 RAB9A (0.47) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL6642970 0.72 RAB9A (0.51) RAB9AKDM4ENPC1SMN1; SMN2ALDH1A1

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