SCHEMBL24916729

SCHEMBL24916729

O=Nc1cc(-c2ccccc2)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.57
ACMSD Q8TDX5 3/20 0.53
HNF4A P41235 2/20 0.53
DHFR P00374 1/20 0.53
MCL1 Q07820 1/20 0.53
ESR2 Q92731 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 2/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
HSP90AA1 P07900 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
HTT P42858 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL12333838 0.83 KDM4E (0.59) ACMSDHNF4ADHFRMCL1KDM4E
SCHEMBL10019608 0.82 MCL1 (0.53) ALOX5MCL1MEN1KMT2AKDM4E
SCHEMBL28177298 0.81 QDPR (0.60) KDM4EALDH1A1LMNAMAPTL3MBTL1
SCHEMBL156635 0.78 MEN1 (0.61) ALOX5ACMSDHNF4ADHFRMCL1
SCHEMBL19970698 0.77 MEN1 (0.72) ALOX5ACMSDHNF4ADHFRMCL1
SCHEMBL14392259 0.77 ACMSD (0.59) ACMSDHNF4ADHFRMCL1
SCHEMBL31185843 0.77 MEN1 (0.59) ALOX5ACMSDHNF4ADHFRMCL1
Methane SCHEMBL28271157 0.76 ALOX5 (0.95) ALOX5ACMSDHNF4ADHFRMCL1
SCHEMBL19833217 0.76 IKBKB (0.50) ALOX5MEN1KMT2AKDM4EUSP2
SCHEMBL19562074 0.73 SMN1; SMN2 (0.59) MEN1KMT2AKDM4EALDH1A1LMNA

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-2023000616-A1 METHOD FOR PREPARING BIFENAZATE 帕潘纳(北京)科技有限公司 2023-01-26 WO disclosed