SCHEMBL14864151

SCHEMBL14864151

CCCCC(=O)Nc1c(C(C)C)cc(Cc2cc(C(C)C)c(NC(=O)CCCC)c(C(C)C)c2)cc1C(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
POLB P06746 1/20 0.47
SOAT1 P35610 2/20 0.45
KDM4E B2RXH2 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL13129155 0.96 SOAT1 (0.47) HPGDPOLBSOAT1SMN1; SMN2NPC1
SCHEMBL14864153 0.94 SOAT1 (0.48) HPGDPOLBSOAT1SMN1; SMN2NPC1
SCHEMBL13129146 0.93 HPGD (0.45) HPGDPOLBSOAT1KDM4ESMN1; SMN2
SCHEMBL13129134 0.81 HPGD (0.63) HPGDPOLBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL12284741 0.80 SMN1; SMN2 (0.45) HPGDSOAT1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL13129142 0.80 HPGD (0.50) HPGDPOLBKDM4EALDH1A1CYP1A2
SCHEMBL13129137 0.77 HPGD (0.58) HPGDPOLBKDM4ESMN1; SMN2ALDH1A1
SCHEMBL10699124 0.76 SOAT1 (0.69) SOAT1SMN1; SMN2
SCHEMBL13129147 0.76 HPGD (0.48) HPGDPOLBSOAT1SMN1; SMN2NPC1
SCHEMBL13129138 0.76 HPGD (0.57) HPGDPOLBSMN1; SMN2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420721-B2 Polyolefin resin composition ADEKA CORPORATION (JP) 2013-04-16 US disclosed