SCHEMBL9007107

SCHEMBL9007107

CCCCCCc1ccc(-c2ccc(-c3ccc(OCCCC)c(F)c3)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 7/20 0.49
▸ RARB P10826 3/20 0.46
▸ RARA P10276 1/20 0.46
▸ RARG P13631 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ USP2 O75604 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ SLCO1B3 Q9NPD5 1/20 0.42
▸ SLCO1B1 Q9Y6L6 1/20 0.42
▸ S1PR3 Q99500 3/20 0.41
▸ S1PR4 O95977 3/20 0.41
▸ S1PR5 Q9H228 3/20 0.41
▸ S1PR2 O95136 1/20 0.41
▸ LPAR2 Q9HBW0 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
SCHEMBL9007133 0.98 S1PR1 (0.47) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL9007184 0.98 S1PR1 (0.47) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL8984266 0.90 S1PR1 (0.42) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL8984295 0.89 RARB (0.47) RARBRARARARGHTR2ASPHK2
SCHEMBL10977024 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL10978778 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL10976307 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL10982546 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL10983275 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2
SCHEMBL9399694 0.87 RARB (0.59) S1PR1RARBRARARARGSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467260-B1 Mesomorphic compound and liquid crystal composition containing same for use in liquid crystal device and display apparatus CANON KK (JP) 1996-10-16 — — EP disclosed
US-5244595-A Phenylthiophene compounds CANON KABUSHIKI KAISHA (JP) 1993-09-14 — — US disclosed
EP-0467260-A2 Mesomorphic compound and liquid crystal composition containing same for use in liquid crystal device and display apparatus CANON KABUSHIKI KAISHA (JP) 1992-01-22 — — EP disclosed
Send feedback