SCHEMBL9937419

SCHEMBL9937419

CCc1ccc(N)c2cc[nH]c12.Cc1ccc(N)c2cc[nH]c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTR2A P28223 1/20 0.33
GAA P10253 2/20 0.33
CFB P00751 2/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
P2RX7 Q99572 2/20 0.32
REN P00797 1/20 0.32
SOS2 Q07890 1/20 0.32
GOT1 P17174 1/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL8349453 0.92 PARP1 (0.39) PARP1RECQLTDP1GAAMEN1
SCHEMBL6192602 0.86 TDP1 (0.38) PARP1RECQLTDP1HTR2AGAA
SCHEMBL20350309 0.83 ALDH1A1 (0.36) PARP1GAACFBMEN1RAB9A
SCHEMBL20756906 0.83 HTR2A (0.39) HTR2ACFBKMT2AMAPTSMN1; SMN2
SCHEMBL28126424 0.80 PARP1 (0.41) PARP1RECQLTDP1GAAMEN1
SCHEMBL18975746 0.78 P2RX7 (0.34) PARP1RECQLTDP1P2RX7
SCHEMBL15629885 0.73 CFB (0.40) CFBMAPTP2RX7RENALDH1A1
SCHEMBL18937034 0.72 CYP1A2 (0.36) CFBMEN1KMT2AKDM4E
SCHEMBL2983820 0.71 ALDH1A1 (0.38) PARP1RECQLTDP1GAACFB
SCHEMBL30954324 0.70 ALDH1A1 (0.39) PARP1RAB9AP2RX7ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651889-A1 4-AMINOINDOLE DERIVATIVES AND USE THEREOF FOR THE OXIDATION DYEING OF KERATIN FIBRES L'Oréal (FR) 2013-10-23 EP claimed
CN-103249718-A 4-aminoindole derivatives and use thereof for the oxidation dyeing of keratin fibres OREAL 2013-08-14 CN claimed
WO-2012080288-A1 4-AMINOINDOLE DERIVATIVES AND USE THEREOF FOR THE OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2012-06-21 WO claimed
EP-2651889-A1 4-AMINOINDOLE DERIVATIVES AND USE THEREOF FOR THE OXIDATION DYEING OF KERATIN FIBRES L'Oréal (FR) 2013-10-23 EP disclosed
CN-103249718-A 4-aminoindole derivatives and use thereof for the oxidation dyeing of keratin fibres OREAL 2013-08-14 CN disclosed
WO-2012080288-A1 4-AMINOINDOLE DERIVATIVES AND USE THEREOF FOR THE OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2012-06-21 WO disclosed