SCHEMBL14977502

SCHEMBL14977502

CCCCCc1c(-c2ccccc2)ccn(C(=O)O)c1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 2/20 0.41
▸ ASAH1 Q13510 2/20 0.41
▸ SOAT1 P35610 2/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MAPT P10636 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ RARB P10826 1/20 0.37
▸ DCTPP1 Q9H773 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
SCHEMBL16057557 0.84 CYP3A4 (0.47) ASAH1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL16057538 0.83 MAPT (0.40) ASAH1ALDH1A1KDM4EMAPTLMNA
SCHEMBL16057331 0.82 DCTPP1 (0.43) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL28510085 0.81 KDM4E (0.48) GCGRHSD11B1ALDH1A1KDM4EMAPT
SCHEMBL16057532 0.79 MAPT (0.39) ASAH1MAPT
SCHEMBL16056895 0.75 RARB (0.48) HSD11B1ALDH1A1MAPTMEN1KMT2A
SCHEMBL14975143 0.73 BID (0.50) KDM4EMAPT
SCHEMBL14977312 0.73 BID (0.50) KDM4EMAPT
SCHEMBL16058205 0.73 BID (0.50) KDM4EMAPT
SCHEMBL16058319 0.73 BID (0.50) KDM4EMAPT

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-2782567-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) The Regents of The University of California (US) 2014-10-01 — — EP disclosed
WO-2013078430-A1 DISUBSTITUTED BETA-LACTONES AS INHIBITORS OF N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-05-30 — — WO disclosed
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