SCHEMBL27419249

SCHEMBL27419249

CCCCNc1ccc(C)c(O)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM6B O15054 1/20 0.40
▸ KDM4C Q9H3R0 1/20 0.40
▸ HCAR3 P49019 2/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ CYP3A4 P08684 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ TLR8 Q9NR97 1/20 0.37
▸ UTS2R Q9UKP6 2/20 0.37
▸ NR4A2 P43354 1/20 0.37
▸ MAPT P10636 4/20 0.36
▸ POLB P06746 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ELANE P08246 1/20 0.35
▸ HTT P42858 2/20 0.35

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
SCHEMBL15934301 0.87 KDM6B (0.39) KDM6BKDM4CHCAR3IDO1CYP3A4
SCHEMBL29118509 0.84 HTT (0.47) KDM6BKDM4CIDO1CYP3A4RECQL
SCHEMBL15934216 0.82 HCAR3 (0.40) KDM6BKDM4CHCAR3IDO1CYP3A4
SCHEMBL21333978 0.80 CYP3A4 (0.57) HCAR3IDO1CYP3A4TSHRRECQL
SCHEMBL1789729 0.76 NAAA (0.45) HCAR3IDO1CNR1CNR2
SCHEMBL8943087 0.76 NAAA (0.45) HCAR3IDO1CNR1CNR2
SCHEMBL9690904 0.76 KDM6B (0.46) KDM6BKDM4CHCAR3CYP3A4TLR8
SCHEMBL15934241 0.76 IDO1 (0.47) KDM6BKDM4CHCAR3IDO1CYP3A4
SCHEMBL10614728 0.73 CNR1 (0.52) IDO1CYP3A4TSHRRECQLTLR8
SCHEMBL5680114 0.73 TYR (0.53) HCAR3CYP3A4TSHRMAPTESR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1089789-C Adhesive for building structures ASAHI CHEMICAL IND (JP) 2002-08-28 — — CN disclosed
CN-1207757-A Adhesive for building structures ASAHI CHEMICAL IND (JP) 1999-02-10 — — CN disclosed
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