SCHEMBL14219362

SCHEMBL14219362

CNCc1ccc2c(-c3ccccc3C(=O)OC)c3ccc(=N)cc-3oc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.73
▸ USP2 O75604 1/20 0.73
▸ CFTR P13569 1/20 0.73
▸ PAX8 Q06710 1/20 0.73
▸ GOPC Q9HD26 1/20 0.73
▸ ABCB1 P08183 1/20 0.72
▸ HTR7 P34969 4/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ PRKDC P78527 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HTT P42858 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL14219272 0.92 USP2 (0.61) ATMUSP2CFTRPAX8GOPC
SCHEMBL14071809 0.90 USP2 (0.59) ATMUSP2CFTRPAX8GOPC
SCHEMBL12285238 0.85 ABCB1 (0.76) ATMUSP2CFTRPAX8GOPC
SCHEMBL10167878 0.85 ABCB1 (0.79) ATMUSP2CFTRPAX8GOPC
SCHEMBL16024743 0.85 ABCB1 (0.79) ATMUSP2CFTRPAX8GOPC
SCHEMBL268381 0.84 ABCB1 (1.00) ATMUSP2CFTRPAX8GOPC
Hydrochloric Acid SCHEMBL3808879 0.83 USP2 (0.98) ATMUSP2CFTRPAX8GOPC
Hydrochloric Acid SCHEMBL29363314 0.83 USP2 (0.98) ATMUSP2CFTRPAX8GOPC
Hydrochloric Acid SCHEMBL18816029 0.83 USP2 (0.98) ATMUSP2CFTRPAX8GOPC
SCHEMBL12173205 0.83 ABCB1 (0.72) ATMUSP2CFTRPAX8GOPC

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-20080090266-A1 Method of Selecting a Cardiomyoctye Using Intracellular Mitochondria as an Indicator ASUBIO PHARMA CO.,LTD (JP) 2008-04-17 — — US disclosed
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