SCHEMBL7087296

SCHEMBL7087296

CCCC=C(C)C(=O)OCCCC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
ATM Q13315 1/20 0.48
TSHR P16473 4/20 0.47
HPGD P15428 1/20 0.46
HCAR2 Q8TDS4 3/20 0.43
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
FAAH O00519 2/20 0.37
RAD52 P43351 1/20 0.37
ESR1 P03372 1/20 0.37
EPHX1 P07099 1/20 0.36

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
SCHEMBL28956750 0.94 TSHR (0.55) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL28107607 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL29117887 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL28014419 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL28107689 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL5864214 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL28107281 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL27914201 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL5864206 0.93 TSHR (0.58) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL8587018 0.92 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106119443-B The grease proofing antifouling care agent of aerosol type surface waterproofing 崔晓雪 2018-08-21 CN disclosed
CN-106119443-A The grease proofing antifouling nursing agent of aerosol type surface waterproofing 崔晓雪 2016-11-16 CN disclosed
US-20030019813-A1 Antimicrobial polymer foams with amino alcohols DE GUSSA AG (DE) 2003-01-30 US disclosed
US-4396680-A Substrate coated with crater resistant acrylic enamel E. I. DU PONT DE NEMOURS AND CO. (US) 1983-08-02 US disclosed
US-4371657-A AMINO RESIN CROSSLINKING E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-02-01 US disclosed