SCHEMBL10966546

SCHEMBL10966546

CCc1cc(NP(=O)(O)O)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 1/20 0.52
▸ CYP1A2 P05177 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ LMNA P02545 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ PSEN1 P49768 1/20 0.34
▸ PSEN2 P49810 1/20 0.34
▸ APH1B Q8WW43 1/20 0.34
▸ NCSTN Q92542 1/20 0.34
▸ APH1A Q96BI3 1/20 0.34
▸ PSENEN Q9NZ42 1/20 0.34
▸ AR P10275 2/20 0.34
▸ FDPS P14324 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CDC7 O00311 1/20 0.33
▸ DBF4 Q9UBU7 1/20 0.33
▸ TERT O14746 1/20 0.33
▸ SRC P12931 1/20 0.33

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
SCHEMBL15880501 0.76 PRKCI (0.62) PRKCICYP1A2POLBLMNASMN1; SMN2
SCHEMBL23015823 0.75 PRKCI (0.61) PRKCICYP1A2POLBLMNAALDH1A1
SCHEMBL26739697 0.74 PRKCI (0.49) PRKCICYP1A2POLBLMNACYP3A4
SCHEMBL27627388 0.73 PRKCI (0.63) PRKCICYP1A2POLBLMNACYP3A4
SCHEMBL23624134 0.73 PRKCI (0.48) PRKCICYP1A2POLBLMNACYP3A4
SCHEMBL14185014 0.72 PRKCI (0.47) PRKCICYP1A2POLBLMNACYP3A4
SCHEMBL21766418 0.70 PRKCI (0.52) PRKCICYP1A2POLBLMNASMN1; SMN2
SCHEMBL25433124 0.70 PRKCI (0.56) PRKCILMNA
SCHEMBL22125117 0.69 SMARCA2 (0.67) PRKCIARMEN1MAPTKMT2A
SCHEMBL25702347 0.69 PRKCI (0.54) PRKCISMN1; SMN2CYP3A4CYP2D6MAPT

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-0069622-B1 PROCESS FOR THE PREPARATION OF BETA-CYCLO-SUBSTITUTED ETHYL AMINES, AND PRODUCTS SO OBTAINED SANOFI S.A. (FR) 1985-09-18 — — EP disclosed
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