SCHEMBL21373882

SCHEMBL21373882

CCOC(OCC)=C(C(=O)Oc1ccc(-c2ccccc2)cc1)C(OCC)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 5/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TARBP2 Q15633 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
FABP7 O15540 1/20 0.37
FABP3 P05413 1/20 0.37

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
SCHEMBL21373881 0.79 NPC1 (0.46) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL29011035 0.75 MEN1 (0.47) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL6976915 0.74 NPC1 (0.51) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL1043461 0.72 MAPT (0.50) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL27957263 0.71 KMT2A (0.55) NPC1RAB9AMAPTKDM4EHSD17B10
SCHEMBL6432240 0.70 SOAT1 (0.48) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL10585445 0.69 MAPT (0.49) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL18812995 0.69 MAPT (0.49) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL7319438 0.68 HSD17B10 (0.52) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL7899007 0.68 MEN1 (0.55) NPC1RAB9AMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190329457-A1 RESIN COMPOSITION FOR FORMING REPLICA MOLD, REPLICA MOLD AND PATTERN FORMING METHOD USING SAID REPLICA MOLD DAICEL CORPORATION (JP) 2019-10-31 US disclosed
EP-3543294-A1 RESIN COMPOSITION FOR FORMING REPLICA MOLD, REPLICA MOLD AND PATTERN FORMING METHOD USING SAID REPLICA MOLD Daicel Corporation (JP) 2019-09-25 EP disclosed