SCHEMBL6600747

SCHEMBL6600747

Cc1cc(N(C)C)c2cc([NH])ccc2n1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TERT O14746 8/20 0.54
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 1/20 0.38
ADORA2A P29274 1/20 0.38
NCF1 P14598 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
NQO2 P16083 1/20 0.34
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
ACP1 P24666 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
SCHEMBL6614139 0.86 TERT (0.43) TERTLMNAALDH1A1CASP1CASP7
SCHEMBL6618425 0.83 TERT (0.39) TERTLMNAALDH1A1CASP1CASP7
SCHEMBL13701566 0.82 LMNA (0.58) TERTLMNAALDH1A1CYP1A2L3MBTL1
SCHEMBL6616872 0.81 TERT (0.40) TERTLMNAALDH1A1HSD17B10ALOX15
SCHEMBL4073181 0.81 TERT (0.55) TERTLMNAALDH1A1CASP1CASP7
SCHEMBL6618332 0.78 ADORA2A (0.54) LMNAALDH1A1HSD17B10MAPK1ADORA2A
SCHEMBL6617731 0.77 TERT (0.51) TERTLMNAALDH1A1CASP1CASP7
SCHEMBL6790532 0.77 CYP1A2 (0.60) TERTALDH1A1CYP1A2ADORA2ANCF1
SCHEMBL5849336 0.76 TERT (0.64) TERTALOX15L3MBTL1NQO2
SCHEMBL6616973 0.75 NCF1 (0.59) TERTALDH1A1CASP1CASP7HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401833-A2 CHEMICAL DERIVATIVES AND THE USE THEREOF AS AN ANTI-ELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-03-31 EP disclosed
EP-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002096903-A2 CHEMICAL DERIVATIVES AND THE USE THEREOF AS AN ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-12-05 WO disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed