SCHEMBL3172696

SCHEMBL3172696

CC(=O)Oc1ccc2cc(-c3nc4ccccc4s3)c(=O)oc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.67
▸ PIK3CB P42338 1/20 0.67
▸ NPC1 O15118 8/20 0.66
▸ RAB9A P51151 8/20 0.66
▸ SMN1; SMN2 Q16637 5/20 0.66
▸ MAPT P10636 2/20 0.66
▸ POLB P06746 2/20 0.66
▸ KDM4E B2RXH2 7/20 0.64
▸ GLA P06280 6/20 0.64
▸ KMT2A Q03164 4/20 0.64
▸ MEN1 O00255 3/20 0.64
▸ ALK Q9UM73 2/20 0.63
▸ HPGD P15428 5/20 0.61
▸ GAA P10253 4/20 0.61
▸ CASP1 P29466 2/20 0.61
▸ CASP7 P55210 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ ALDH1A1 P00352 4/20 0.57
▸ S1PR4 O95977 1/20 0.51
▸ S1PR1 P21453 1/20 0.51

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
SCHEMBL21133105 0.88 PIK3CD (0.65) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL16312867 0.84 PIK3CD (0.65) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL15086130 0.83 PIK3CD (0.58) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL28838097 0.81 PIK3CD (0.56) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
Methyl Alcohol SCHEMBL28838102 0.81 PIK3CD (0.95) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL592311 0.81 PIK3CD (1.00) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL29524563 0.81 PIK3CD (1.00) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL2623784 0.81 PIK3CD (0.74) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL29427470 0.81 PIK3CD (1.00) PIK3CDPIK3CBNPC1RAB9ASMN1; SMN2
SCHEMBL29427524 0.80 NPC1 (0.72) NPC1RAB9ASMN1; SMN2MAPTKDM4E

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
US-7790245-B2 Photo curable ink composition set, and recording method and recordings employing ink composition set SEIKO EPSON CORPORATION (JP) 2010-09-07 — — US disclosed
US-20080096998-A1 Photo curable ink composition set, and recording method and recordings employing ink composition set SEIKO EPSON CORPORATION (JP) 2008-04-24 — — US disclosed
EP-1914279-A2 Photo curable ink composition set, and recording method and recordings employing ink compositon set Seiko Epson Corporation (JP) 2008-04-23 — — EP disclosed
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