SCHEMBL10620372

SCHEMBL10620372

CC/C=C(\C)C(=O)OCCCCC

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.56
NAAA Q02083 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HCAR2 Q8TDS4 2/20 0.46
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.44
ATM Q13315 1/20 0.44
FAAH O00519 2/20 0.43
CES2 O00748 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL375532 1.00 TSHR (0.56) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL236897 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL28277932 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL375028 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL375393 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL374916 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL11142775 0.98 TSHR (0.59) TSHRNAAAALDH1A1HCAR2RAD52
Pentadecane SCHEMBL27714673 0.94 TSHR (0.55) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL7752796 0.94 ALDH1A1 (0.54) TSHRNAAAALDH1A1HCAR2RAD52
SCHEMBL374983 0.94 ALDH1A1 (0.54) TSHRNAAAALDH1A1HCAR2RAD52

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-4748145-A Catalysts having alkoxide-modified supports and method of increasing the catalytic activity of a catalytic metal THE DOW CHEMICAL COMPANY (US) 1988-05-31 US disclosed
US-4743705-A FROM HALOALKENE, ALCOHOL OR ETHER, CARBON MONOXIDE THE DOW CHEMICAL COMPANY (US) 1988-05-10 US disclosed
US-4686314-A CALCINING METAL ALKOXIDE TO GLUE METAL OXIDE THE DOW CHEMICAL COMPANY (US) 1987-08-11 US disclosed
EP-0225953-A1 Catalysts having alkoxide-modified supports THE DOW CHEMICAL COMPANY (US) 1987-06-24 EP disclosed