SCHEMBL8552728

SCHEMBL8552728

Clc1ccc2nc(C=Cc3ccccc3)n(-c3ccccc3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 2/20 0.56
TUBB P07437 2/20 0.56
TUBA3C P0DPH7 2/20 0.56
TUBA1B P68363 2/20 0.56
TUBA4A P68366 2/20 0.56
TUBB4B P68371 2/20 0.56
TUBB3 Q13509 2/20 0.56
TUBB2A Q13885 2/20 0.56
TUBB8 Q3ZCM7 2/20 0.56
TUBA3E Q6PEY2 2/20 0.56
TUBA1A Q71U36 2/20 0.56
TUBA1C Q9BQE3 2/20 0.56
TUBB6 Q9BUF5 2/20 0.56
TUBB2B Q9BVA1 2/20 0.56
TUBB1 Q9H4B7 2/20 0.56
KDM4E B2RXH2 3/20 0.48
NPC1 O15118 3/20 0.48
ALDH1A1 P00352 3/20 0.48
RAB9A P51151 3/20 0.48
MAPT P10636 3/20 0.48

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
SCHEMBL8552722 1.00 TUBB4A (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8551282 0.89 PDE10A (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8551275 0.89 PDE10A (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8550750 0.82 KDM4E (0.64) KDM4ENPC1ALDH1A1RAB9AMAPT
SCHEMBL6583378 0.82 KDM4E (0.64) KDM4ENPC1ALDH1A1RAB9AMAPT
SCHEMBL6583386 0.82 KDM4E (0.64) KDM4ENPC1ALDH1A1RAB9AMAPT
SCHEMBL4928572 0.77 KDM4E (0.50) KDM4ENPC1ALDH1A1RAB9AKMT2A
SCHEMBL6582603 0.75 MAPT (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6585280 0.75 ALDH1A1 (0.59) KDM4ENPC1ALDH1A1RAB9AMAPT
SCHEMBL6585289 0.75 ALDH1A1 (0.59) KDM4ENPC1ALDH1A1RAB9AMAPT

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-0846689-A1 Benzimidazole compounds PFIZER INC. (US) 1998-06-10 EP disclosed