SCHEMBL8382803

SCHEMBL8382803

C=CC(=O)OCCO.CCCCC=C(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.54
HPGD P15428 1/20 0.54
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 1/20 0.42
TP53 P04637 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ATM Q13315 1/20 0.38
HCAR2 Q8TDS4 3/20 0.37
THRB P10828 2/20 0.37
MGLL Q99685 1/20 0.37
ACHE P22303 1/20 0.36
EP300 Q09472 1/20 0.36
GRIK1 P39086 1/20 0.33

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
SCHEMBL9776659 0.90 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL6710670 0.89 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL4606590 0.88 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8009298 0.86 TSHR (0.55) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL9242066 0.86 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8899317 0.86 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28032490 0.86 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8641969 0.86 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL7198246 0.86 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28544460 0.85 TSHR (0.55) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0600262-B1 Aqueous processable, multilayer photoimageable permanent coatings for printed circuits DU PONT (US) 1999-04-21 EP disclosed
EP-0600262-A2 Aqueous processable, multilayer photoimageable permanent coatings for printed circuits E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-06-08 EP disclosed
US-5288589-A Storage stability E.I. DU PONT DE NEMOURS AND COMPANY 1994-02-22 US disclosed