SCHEMBL14040052

SCHEMBL14040052

CCCCC(C)c1ccc2c(c1)oc1cc(N(c3ccc4oc5ccccc5c4c3)C(C)(C)CCCC)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ CYP2D6 P10635 2/20 0.33
▸ BCHE P06276 4/20 0.33
▸ ACHE P22303 4/20 0.33
▸ MMP12 P39900 2/20 0.31
▸ MMP13 P45452 2/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ CYP2C19 P33261 2/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL18174891 0.82 NPC1 (0.42) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL24906570 0.71 PTPN1 (0.43) SMN1; SMN2NPC1RAB9AALDH1A1HTT
SCHEMBL14040054 0.70 NPC1 (0.32) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14040032 0.70 TNKS (0.35) —
SCHEMBL14040108 0.69 CNR1 (0.33) SMN1; SMN2NPC1RAB9A
SCHEMBL12386886 0.69 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL21237911 0.69 AHR (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL9963713 0.69 AHR (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL8610438 0.65 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL25789591 0.65 NPC1 (0.45) SMN1; SMN2NPC1RAB9AMEN1KMT2A

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
EP-1357436-B1 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KK (JP) 2008-10-22 — — EP disclosed
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