SCHEMBL6934134

SCHEMBL6934134

[CH2]CCCCCOCC(C)Cl

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34
HTT P42858 1/20 0.33
PRKD3 O94806 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCB P05771 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCH P24723 1/20 0.33
PRKCI P41743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCZ Q05513 1/20 0.33
PRKCD Q05655 1/20 0.33
PRKD1 Q15139 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
SCHEMBL6936556 1.00 USP2 (0.34) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL6933613 0.91
SCHEMBL6934725 0.83 SPHK1 (0.33) USP2SPHK1HTT
SCHEMBL6939332 0.83 SPHK1 (0.33) USP2SPHK1HTT
SCHEMBL6654969 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL6650342 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL2152604 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL2152710 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL6651656 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG
SCHEMBL9149315 0.82 SPHK1 (0.39) USP2SPHK1HTTPRKD3PRKCG

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-0962445-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS INC (JP) 2003-02-26 EP disclosed
EP-0751133-B1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-09-12 EP disclosed
US-6217793-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS, INC. (JP) 2001-04-17 US disclosed
EP-0962445-A1 Acetylene compound, liquid crystal composition and liquid crystal element Mitsui Chemicals, Inc. (JP) 1999-12-08 EP disclosed
US-5770108-A HIGH SPEED RESPONSE, MOLECULAR ORIENTATION, HIGH CONTRAST, RECEPTIVITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-23 US disclosed
EP-0751133-A1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-02 EP disclosed