SCHEMBL8311968

SCHEMBL8311968

CCOC(=O)C(C)(C)CCCC=S

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.61
CYP4A11 Q02928 3/20 0.61
PKM P14618 3/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ACLY P53396 1/20 0.35
MMP8 P22894 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 2/20 0.33
ABCB11 O95342 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
HTR2A P28223 1/20 0.33
PMP22 Q01453 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
SCHEMBL4096371 0.83 CYP4F2 (0.62) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL6254544 0.82 CYP4F2 (0.85) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL6257314 0.82 CYP4F2 (0.85) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL2895961 0.81 CYP4F2 (0.61) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL7941258 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL20613555 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL20713255 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL20713329 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL31108848 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL31108907 0.80 CYP4F2 (0.69) CYP4F2CYP4A11PKMTHRBHTT

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
EP-0742200-B1 Manufacturing method of sulphides KONISHIROKU PHOTO IND (JP) 1999-07-21 EP disclosed
EP-0562439-B1 Triazolopyridazines as antioasthmatics TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-06-09 EP disclosed
EP-0742200-A1 Manufacturing method of sulphides KONICA CORPORATION (JP) 1996-11-13 EP disclosed
US-5482939-A ANTI-PLATELET ACTIVATING FACTOR ACTIVITIES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-09 US disclosed
US-5389633-A ANTIASTHMATIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US disclosed
EP-0562439-A1 Triazolopyridazines as antioasthmatics TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-29 EP disclosed