SCHEMBL8897102

SCHEMBL8897102

CCCCCCCCC(S)CCC(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.47
CA12 O43570 2/20 0.46
CA14 Q9ULX7 2/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
POLB P06746 1/20 0.45
POLA1 P09884 1/20 0.45
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PPARG P37231 2/20 0.44
TSHR P16473 2/20 0.43
LMNA P02545 3/20 0.43
USP2 O75604 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARA Q07869 1/20 0.41
KDM5A P29375 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
SCHEMBL18681871 0.93 LMNA (0.50) ZDHHC7CA12CA14CA2CA7
SCHEMBL17173340 0.93 LMNA (0.50) ZDHHC7CA12CA14CA2CA7
SCHEMBL8416314 0.93 LMNA (0.50) ZDHHC7CA12CA14CA2CA7
SCHEMBL17173344 0.91 PPARG (0.49) ZDHHC7CA12CA14CA2CA7
SCHEMBL29129028 0.85 TSHR (0.56) HPGDRECQLKMT2AHSD17B10PPARG
SCHEMBL15954875 0.85 TSHR (0.56) HPGDRECQLKMT2AHSD17B10PPARG
SCHEMBL11806080 0.84 ZDHHC7 (0.49) ZDHHC7CA12CA14CA2CA7
SCHEMBL28608801 0.84 ZDHHC7 (0.49) ZDHHC7CA12CA14CA2CA7
SCHEMBL5898833 0.84 ZDHHC7 (0.49) ZDHHC7CA12CA14CA2CA7
SCHEMBL27499208 0.83 NAAA (0.55) TSHR

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
US-5696282-A CATALYTIC REACTION OF A HYDROGEN SULFIDE OR MERCAPTAN WITH UNSATURATED CARBONYL OR CYANO COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1997-12-09 US claimed
US-5696282-A CATALYTIC REACTION OF A HYDROGEN SULFIDE OR MERCAPTAN WITH UNSATURATED CARBONYL OR CYANO COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1997-12-09 US disclosed