SCHEMBL9480309

SCHEMBL9480309

C=CC(=O)OC(CCCCC)OCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
SMPD1 P17405 3/20 0.40
HCAR2 Q8TDS4 1/20 0.38
PLA2G2C Q5R387 1/20 0.38
LMNA P02545 2/20 0.38
THRB P10828 2/20 0.37
THRA P10827 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 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
SCHEMBL10715320 0.94 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL4134511 0.91 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL16949659 0.89 TSHR (0.43) TSHRHPGDSMPD1LMNATHRB
SCHEMBL4957917 0.89 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL786290 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1
SCHEMBL542079 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1
SCHEMBL486802 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1
SCHEMBL4951003 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1
SCHEMBL4578058 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1
SCHEMBL31520063 0.89 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5244995-A Vinyl halide aqueous polymerization dispersant system THE BF GOODRICH COMPANY (US) 1993-09-14 US disclosed
US-5155189-A Derived from repeating units of acrylic and/or methacrylic ester polymers THE B. F. GOODRICH COMPANY (US) 1992-10-13 US disclosed
EP-0483051-A1 Improved vinyl halide aqueous polymerization dispersant system The Geon Company (US) 1992-04-29 EP disclosed
US-4190693-A WATERBASE, THERMOSETTING RESINS FOR DIRECT ROLL COATING ROHM AND HAAS COMPANY (US) 1980-02-26 US disclosed
US-4126595-A Aqueous coating compositions comprising acrylic oligomers, high molecular weight polymers and crosslinkers ROHM AND HAAS COMPANY (US) 1978-11-21 US disclosed
US-4087397-A Aqueous coating compositions comprising acrylic oligomers and high molecular weight polymers ROHM AND HAAS COMPANY (US) 1978-05-02 US disclosed