SCHEMBL8970376

SCHEMBL8970376

CCCCCCOC1CCC(C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.44
S1PR5 Q9H228 10/20 0.41
NAAA Q02083 3/20 0.41
S1PR1 P21453 6/20 0.40
S1PR3 Q99500 4/20 0.40
CES2 O00748 1/20 0.40
GBA1 P04062 1/20 0.40
PPP5C P53041 1/20 0.38

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
SCHEMBL8970509 1.00 EPHX2 (0.44) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8970086 1.00 EPHX2 (0.44) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8969164 1.00 EPHX2 (0.44) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8969446 0.98 EPHX2 (0.45) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8970567 0.93 PPP5C (0.43) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8969252 0.91 NAAA (0.46) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL11672195 0.90 S1PR5 (0.46) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL11406200 0.90 S1PR5 (0.46) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL2497591 0.88 EPHX2 (0.47) EPHX2S1PR5NAAAS1PR1S1PR3
SCHEMBL8969589 0.86 PPM1B (0.36) EPHX2S1PR5PPP5C

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
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed