SCHEMBL23401034

SCHEMBL23401034

CCCc1cc(O)nn1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.51
ALDH1A1 P00352 6/20 0.44
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
GAA P10253 2/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
APLNR P35414 1/20 0.38
NT5E P21589 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
FCGR1A P12314 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KDM4A O75164 1/20 0.37
KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL23401114 0.90 CNR1 (0.48) USP2ALDH1A1LMNATSHRCNR1
SCHEMBL23403068 0.88 LMNA (0.48) USP2ALDH1A1LMNATSHRCNR1
SCHEMBL23399594 0.85 USP2 (0.40) USP2ALDH1A1LMNATSHRMAPK1
SCHEMBL23401971 0.84 ALDH1A1 (0.45) USP2ALDH1A1LMNAGAAAPLNR
SCHEMBL23401534 0.81 LMNA (0.44) ALDH1A1LMNAGAAMAPK1CYP1A2
SCHEMBL28187486 0.81 KDM4A (0.38) USP2ALDH1A1LMNATSHRGAA
SCHEMBL23402955 0.80 KCNH2 (0.52) ALDH1A1GAA
SCHEMBL4851223 0.80 FHIT (0.38) USP2ALDH1A1LMNATSHRGAA
SCHEMBL23403608 0.79 ALDH1A1 (0.41) USP2ALDH1A1TSHRMAPK1APLNR
SCHEMBL4850432 0.79 HRH3 (0.41) USP2ALDH1A1LMNAGAACYP1A2

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed