SCHEMBL31008992

SCHEMBL31008992

Cn1nnc(-c2ccccc2O)c1COC1CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE7A Q13946 1/20 0.36
▸ CHRM1 P11229 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NR1I2 O75469 1/20 0.32
▸ SMARCA2 P51531 1/20 0.32
▸ SMARCA4 P51532 1/20 0.32
▸ NR1H2 P55055 1/20 0.32
▸ NR1H3 Q13133 1/20 0.32
▸ PBRM1 Q86U86 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31

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
SCHEMBL28435767 0.84 KDM4E (0.39) PDE4DPDE7ACHRM1NR1I2SMARCA2
SCHEMBL25278645 0.84 KDM4C (0.35) KDM4CEP300CREBBPNPC1RAB9A
SCHEMBL21058017 0.84 GABRA5 (0.40) KDM4CPDE4DPDE7AEP300CREBBP
SCHEMBL30740368 0.81 TGFBR1 (0.44) KDM4CALOX15NPC1RAB9AKDM4E
SCHEMBL19715757 0.81 SLCO1B1 (0.38) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL29411759 0.81 SLCO1B1 (0.38) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL22806839 0.80 SLCO1B1 (0.41) KDM4CCREBBPMEN1KMT2ANPC1
SCHEMBL21058053 0.78 LPAR1 (0.40) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL25422781 0.78 SLCO1B1 (0.39) KDM4CPDE4DPDE7AMEN1KMT2A
SCHEMBL25231360 0.78 SLCO1B1 (0.35) KDM4CNPC1RAB9A

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-112055711-B Cyclohexylic acid triazolazine as LPA antagonist 百时美施贵宝公司 2024-07-23 — — CN disclosed
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