SCHEMBL14219272

SCHEMBL14219272

CCOC(=O)c1ccccc1-c1c2ccc(=N)cc-2oc2cc(CNC)ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.61
▸ CFTR P13569 1/20 0.61
▸ PAX8 Q06710 1/20 0.61
▸ ATM Q13315 1/20 0.61
▸ GOPC Q9HD26 1/20 0.61
▸ ABCB1 P08183 1/20 0.61
▸ ALDH1A1 P00352 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ ESR1 P03372 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL14219362 0.92 ATM (0.73) USP2CFTRPAX8ATMGOPC
SCHEMBL14071809 0.88 USP2 (0.59) USP2CFTRPAX8ATMGOPC
SCHEMBL20042562 0.85 ABCB1 (0.80) USP2CFTRPAX8ATMGOPC
SCHEMBL13820288 0.83 ABCB1 (0.59) USP2CFTRPAX8ATMGOPC
SCHEMBL16024743 0.79 ABCB1 (0.79) USP2CFTRPAX8ATMGOPC
SCHEMBL13820277 0.78 ABCB1 (0.54) USP2CFTRPAX8ATMGOPC
SCHEMBL12285238 0.77 ABCB1 (0.76) USP2CFTRPAX8ATMGOPC
SCHEMBL10167878 0.77 ABCB1 (0.79) USP2CFTRPAX8ATMGOPC
SCHEMBL12173205 0.77 ABCB1 (0.72) USP2CFTRPAX8ATMGOPC
SCHEMBL20041379 0.76 ABCB1 (0.71) USP2CFTRPAX8ATMGOPC

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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