SCHEMBL10468849

SCHEMBL10468849

CCCn1c(C)c([C@@H](C)[C@@H](N)C(=O)OC)c2cc(C)ccc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.41
▸ HSD17B10 Q99714 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ PLA2G2A P14555 5/20 0.39
▸ GAA P10253 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ PSEN1 P49768 1/20 0.37
▸ PSEN2 P49810 1/20 0.37
▸ APH1B Q8WW43 1/20 0.37
▸ NCSTN Q92542 1/20 0.37
▸ APH1A Q96BI3 1/20 0.37
▸ PSENEN Q9NZ42 1/20 0.37

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 0.89 PSEN1 (0.48) HSD17B10ALDH1A1KDM4EHPGDPLA2G2A
SCHEMBL10466593 0.83 PSEN1 (0.54) CNR2HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL10468538 0.80 KDM4E (0.48) CNR2ALDH1A1KDM4ELMNA
SCHEMBL10465938 0.78 CNR2 (0.41) CNR2HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL10467254 0.78 CTSL (0.42) CNR2ALDH1A1KDM4EPLA2G2AGAA
SCHEMBL10468371 0.73 MTNR1A (0.47) HSD17B10ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL10085034 0.71 LMNA (0.55) CNR2HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL28621894 0.71 POLB (0.48) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL10467315 0.70 ALDH1A1 (0.43) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL10467761 0.69 CCR1 (0.43) ALDH1A1KDM4EPLA2G2AGAALMNA

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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