SCHEMBL9369316

SCHEMBL9369316

CC(C)Cc1ccc(CN(Cc2cccc(C(=O)O)c2)c2ccc(CC(C)C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MEP1B Q16820 13/20 0.50
▸ MEP1A Q16819 3/20 0.48
▸ PTPN1 P18031 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ FOLH1 Q04609 4/20 0.45
▸ ANPEP P15144 1/20 0.44
▸ ENPEP Q07075 1/20 0.44

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
SCHEMBL9373488 0.89 PTPN1 (0.51) MEP1BPTPN1ALOX5
SCHEMBL9538619 0.85 NR3C1 (0.46) MEP1BMEP1APTPN1ALOX5
SCHEMBL9372874 0.84 PTGES (0.55) MEP1BMEP1AALOX5
SCHEMBL9372894 0.84 PTGES (0.55) MEP1BMEP1AALOX5
SCHEMBL765921 0.81 FOLH1 (0.61) MEP1BFOLH1ANPEPENPEP
SCHEMBL9369252 0.81 ALOX5 (0.48) ALOX5
SCHEMBL9376678 0.79 PTGES (0.47) MEP1BMEP1AALOX5FOLH1ANPEP
SCHEMBL8792890 0.78 MRGPRX4 (0.52) ALOX5FOLH1ANPEPENPEP
SCHEMBL6952400 0.75 PTPN1 (0.68) MEP1BMEP1APTPN1FOLH1
SCHEMBL9374304 0.75 MRGPRX4 (0.74) —

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
EP-0600084-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 — — EP disclosed
WO-1993003012-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-18 — — WO disclosed
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