SCHEMBL7463136

SCHEMBL7463136

Nc1cccc(-n2[nH]ccc2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CASP1 P29466 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP7 P55210 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
ADRA2C P18825 1/20 0.40
CYP3A4 P08684 1/20 0.38
RECQL P46063 1/20 0.38
USP2 O75604 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
LMNA P02545 2/20 0.37
ALOX12 P18054 1/20 0.37
ALKBH5 Q6P6C2 2/20 0.36

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
SCHEMBL10948802 0.81 MEN1 (0.49) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
3-Aminobenzoic Acid SCHEMBL11798899 0.81 KDM2B (0.49) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL10947683 0.79 FAAH (0.49) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL456557 0.79 ALKBH5 (0.56) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5440730 0.77 DDB1 (0.39) DDB1CRBNMAPTALDH1A1MEN1
SCHEMBL1232067 0.77 TSHR (0.48) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7893151 0.76 MAPT (0.54) DDB1CRBNMAPTALDH1A1MEN1
Phosphine SCHEMBL9466938 0.75 TSHR (0.47) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL692284 0.75 KDM2B (0.56) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7456550 0.75 MAPT (0.44) MAPTALDH1A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1231889-A2 DIRECT HAIR DYES AND USE THEREOF Henkel Kommanditgesellschaft auf Aktien (DE) 2002-08-21 EP disclosed
EP-1218344-A2 OXIDATION COLORANT STARTING PRODUCTS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-07-03 EP disclosed
EP-1210060-A2 NEW DEVELOPER-COUPLER COMBINATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-06-05 EP disclosed
EP-1185234-A1 NEW COUPLING COMPONENTS FOR OXIDATION HAIR COLORANTS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-03-13 EP disclosed
WO-2001026615-A2 DIRECT HAIR DYES CONTAINING A HYDROXYANTHROQUINONE DERIVATIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-04-19 WO disclosed
WO-2001000152-A1 NEW COUPLING COMPONENTS FOR OXIDATION HAIR COLORANTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-01-04 WO disclosed
WO-2001000142-A2 DEVELOPER-COUPLER COMBINATIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-01-04 WO disclosed
WO-2000076977-A2 OXIDATION COLORANT STARTING PRODUCTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-12-21 WO disclosed
US-4246410-A BENZINDOLE DYES OF YELLOW AND RED CIBA -GEIGY AKTIENGESELLSCHAFT (CH) 1981-01-20 US disclosed
US-4189427-A Azo dyestuffs from benzene diazo component fused to an aliphatic ring and containing two cyano substituents ortho to the azo group BAYER AKTIENGESELLSCHAFT (DE) 1980-02-19 US disclosed