SCHEMBL10466593

SCHEMBL10466593

CCCCn1c(C)c([C@@H](C)[C@@H](N)C(=O)OC)c2cc(Cl)ccc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 7/20 0.54
▸ PSEN2 P49810 7/20 0.54
▸ APH1B Q8WW43 7/20 0.54
▸ NCSTN Q92542 7/20 0.54
▸ APH1A Q96BI3 7/20 0.54
▸ PSENEN Q9NZ42 7/20 0.54
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ PLA2G2A P14555 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CNR2 P34972 2/20 0.39
▸ RORA P35398 1/20 0.39
▸ RORC P51449 1/20 0.39
▸ NR1H2 P55055 1/20 0.39
▸ RORB Q92753 1/20 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
SCHEMBL10466621 0.94 PSEN1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10468538 0.85 KDM4E (0.48) KDM4EALDH1A1CNR2
SCHEMBL10468849 0.83 CNR2 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10465937 0.79 PSEN1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10467761 0.73 CCR1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10467514 0.71 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27693251 0.71 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1921483 0.69 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8687419 0.68 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10467315 0.67 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1HPGDTSHR

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
US-4940709-A PLATELET ACTIVATING FACTOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 — — US disclosed
US-4806538-A ANTICOAGULANT, HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-02-21 — — US disclosed
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