SCHEMBL9650226

SCHEMBL9650226

CCCCCCCCCCCCOc1ccc(Cc2c(Oc3ccc(OCOC)c(Cl)c3Cc3ccc(OCCCCCCCCCCCC)cc3)ccc(OCOC)c2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
TP53 P04637 3/20 0.41
HPGD P15428 1/20 0.41
NR5A1 Q13285 1/20 0.41
LTA4H P09960 2/20 0.40
PLA2G2A P14555 1/20 0.40
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PLA2G4B P0C869 1/20 0.38
TSHR P16473 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
SCHEMBL9650320 0.84 NR5A1 (0.51) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL9650863 0.81 NR5A1 (0.49) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL9650233 0.76 SMN1; SMN2 (0.45) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL12267160 0.75 NR5A1 (0.63) NPC1RAB9ATP53NR5A1LTA4H
SCHEMBL2868500 0.73 ALDH1A1 (0.47) HPGDPLA2G2A
SCHEMBL14569089 0.71 PLA2G2A (0.48) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL19602208 0.71 PLA2G2A (0.48) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL19603046 0.71 PLA2G2A (0.48) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL14618159 0.71 NR5A1 (0.58) NPC1RAB9ATP53HPGDNR5A1
SCHEMBL8706961 0.71 PLA2G4B (0.53) HPGDNR5A1L3MBTL1PLA2G4BTSHR

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-0321984-B1 MESOMORPHIC COMPOUND HAVING BETA-HYDROXYCARBOXYL GROUP AS CHIRAL SOURCE AND LIQUID CRYSTAL COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 1992-10-21 EP disclosed
US-4925591-A FERROELECTRIC MITSUBISHI RAYON CO., LTD. (JP) 1990-05-15 US disclosed
EP-0321984-A1 Mesomorphic compound having beta-hydroxycarboxyl group as chiral source and liquid crystal composition MITSUBISHI RAYON CO., LTD. (JP) 1989-06-28 EP disclosed