SCHEMBL27716754

SCHEMBL27716754

O=C(Nc1cc(C=Cc2ccccc2)ccc1C(=O)O)c1ccccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMO Q99835 2/20 0.67
▸ CYP1A2 P05177 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ SLC16A1 P53985 1/20 0.51
▸ TRPA1 O75762 2/20 0.49
▸ SLC16A3 O15427 1/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ MAPT P10636 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GRIK1 P39086 1/20 0.48
▸ PTPN1 P18031 1/20 0.48
▸ HNF4A P41235 1/20 0.48
▸ PRSS12 P56730 1/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.46
▸ KCNK3 O14649 1/20 0.46
▸ KCNK9 Q9NPC2 1/20 0.46

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
SCHEMBL27697003 0.88 SMO (0.51) SMOTRPA1SLC16A3GRIK1PTPN1
SCHEMBL28943766 0.84 L3MBTL1 (0.50) SMOTRPA1RAB9ANPC1LMNA
SCHEMBL27696984 0.84 SLC16A3 (0.53) SMOHPGDSLC16A3RAB9AMAPT
SCHEMBL2276651 0.83 PKM (0.62) MAPTGRIK1PTPN1HNF4A
SCHEMBL2276655 0.83 PKM (0.62) MAPTGRIK1PTPN1HNF4A
SCHEMBL27696790 0.83 KCNK2 (0.56) TRPA1MAPTGRIK1PRSS12
SCHEMBL27696988 0.83 ACLY (0.67) HPGDTRPA1MAPTALDH1A1LMNA
SCHEMBL1308314 0.82 GRIK1 (0.69) CYP1A2HPGDCYP2C19MAPTKDM4E
SCHEMBL27696846 0.81 GRIK1 (0.59) HPGDSLC16A3RAB9AMAPTALDH1A1
SCHEMBL27716689 0.81 MEN1 (0.56) TRPA1ALDH1A1LMNAGRIK1PTPN1

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-101094829-A Novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD (JP) 2007-12-26 — — CN disclosed
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