SCHEMBL30137005

SCHEMBL30137005

Clc1ccc(Br)cc1Cc1ccc2c(c1)CCO2

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 10/20 0.42
GSK3B P49841 2/20 0.38
RAB9A P51151 2/20 0.38
KDM1A O60341 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
SLC5A1 P13866 2/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
BLM P54132 1/20 0.36
PRKCI P41743 1/20 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
SCHEMBL10040915 1.00 SLC5A2 (0.42) SLC5A2GSK3BRAB9AKDM1AMAOA
SCHEMBL14128414 0.85 SLC5A2 (0.53) SLC5A2MAOBSLC5A1LMNAMAPT
SCHEMBL19019454 0.81 SLC5A2 (0.44) SLC5A2GSK3BRAB9AKDM1AMAOA
SCHEMBL20139367 0.80 SLC5A2 (0.48) SLC5A2SLC5A1
SCHEMBL1670103 0.78 SLC5A2 (0.43) SLC5A2SLC5A1LMNAMAPTHTT
SCHEMBL20139399 0.78 SLC5A2 (0.42) SLC5A2POLBSLC5A1
SCHEMBL19019416 0.78 SLC5A2 (0.48) SLC5A2GSK3BSLC5A1
SCHEMBL155111 0.75 MAPT (0.53) RAB9AMAOBNPC1LMNAMAPT
SCHEMBL29584634 0.75 MAPT (0.53) RAB9AMAOBNPC1LMNAMAPT
SCHEMBL28524657 0.74 SLC5A2 (0.51) SLC5A2SLC5A1

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
CN-113135966-B Bicyclic derivatives of heterocyclic glucoside and preparation method and application thereof 华润双鹤药业股份有限公司 2022-12-16 CN disclosed