SCHEMBL12705745

SCHEMBL12705745

CCCCCCCCOC(=O)C(CC(C)C)NC

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.56
▸ ACHE P22303 8/20 0.46
▸ NAAA Q02083 1/20 0.46
▸ PLA2G2A P14555 2/20 0.44
▸ PLA2G5 P39877 2/20 0.44
▸ FAAH O00519 1/20 0.42
▸ TSHR P16473 2/20 0.42

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
SCHEMBL12705744 1.00 EPHX1 (0.56) EPHX1ACHENAAAPLA2G2APLA2G5
SCHEMBL16298724 0.93 EPHX1 (0.46) EPHX1ACHEPLA2G2APLA2G5TSHR
SCHEMBL13519757 0.93 EPHX1 (0.46) EPHX1ACHEPLA2G2APLA2G5TSHR
SCHEMBL25602454 0.86 TAS1R3 (0.45) EPHX1PLA2G2APLA2G5
Hydrochloric Acid SCHEMBL28285941 0.84 TAS1R3 (0.44) EPHX1PLA2G2APLA2G5
Hydrochloric Acid SCHEMBL28285940 0.84 TAS1R3 (0.44) EPHX1PLA2G2APLA2G5
SCHEMBL11675841 0.84 ALDH1A1 (0.50) EPHX1ACHENAAAPLA2G2APLA2G5
SCHEMBL11675839 0.84 ALDH1A1 (0.50) EPHX1ACHENAAAPLA2G2APLA2G5
SCHEMBL18380899 0.84 SLC7A5 (0.39) EPHX1ACHE
SCHEMBL13960047 0.84 ALDH1A1 (0.50) EPHX1PLA2G2APLA2G5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7919572-B2 Polyamino acids functionalised with at least one hydrophobic group and applications thereof particularly therapeutic applications FLAMEL TECHNOLOGIES (FR) 2011-04-05 — — US disclosed
US-7919572-B2 Polyamino acids functionalised with at least one hydrophobic group and applications thereof particularly therapeutic applications FLAMEL TECHNOLOGIES (FR) 2011-04-05 — — US disclosed
US-20070010652-A1 Polyamino acids functionalised with at least one hydrophobic group and applications thereof particularly therapeutic applications STEPHANIE ANGOT, OLIVIER BREYNE, AND YOU-PING CHAN 2007-01-11 — — US disclosed
US-20070010652-A1 Polyamino acids functionalised with at least one hydrophobic group and applications thereof particularly therapeutic applications STEPHANIE ANGOT, OLIVIER BREYNE, AND YOU-PING CHAN 2007-01-11 — — US disclosed
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