SCHEMBL9368860

SCHEMBL9368860

COC(=O)c1cccc(CN(C(=O)c2ccc(CC(C)C)cc2)c2cccc(CC(C)C)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.51
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ LOXL2 Q9Y4K0 1/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CYP4F2 P78329 2/20 0.44
▸ CYP4A11 Q02928 2/20 0.44
▸ FOLH1 Q04609 1/20 0.43
▸ PTGES O14684 2/20 0.43
▸ ALOX5 P09917 2/20 0.43
▸ CETP P11597 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ NR1H4 Q96RI1 1/20 0.41
▸ HIF1A Q16665 1/20 0.39
▸ MEP1B Q16820 1/20 0.39
▸ ITGB1 P05556 2/20 0.39
▸ ITGA4 P13612 2/20 0.39

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
SCHEMBL9541159 0.93 SLC7A5 (0.50) SLC7A5RAB9ANPC1LOXL2MAPT
SCHEMBL9541373 0.90 SLC7A5 (0.52) SLC7A5RAB9ANPC1LOXL2MAPT
SCHEMBL9376678 0.88 PTGES (0.47) RAB9ANPC1FOLH1PTGESALOX5
SCHEMBL9369194 0.88 NPC1 (0.49) SLC7A5RAB9ANPC1PTGESALOX5
SCHEMBL9372770 0.84 SLC7A5 (0.46) SLC7A5RAB9ANPC1LOXL2MAPT
SCHEMBL9538478 0.81 PTGES (0.53) RAB9ANPC1PTGESALOX5KMT2A
SCHEMBL1790854 0.81 SLC7A5 (0.68) SLC7A5RAB9ANPC1LOXL2MAPT
SCHEMBL9372894 0.81 PTGES (0.55) RAB9ANPC1PTGESALOX5KMT2A
SCHEMBL9368612 0.80 PTGES (0.52) RAB9ANPC1SMN1; SMN2PTGESALOX5
SCHEMBL9369673 0.79 SLC7A5 (0.44) SLC7A5RAB9ALOXL2MAPTKDM4E

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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