SCHEMBL10883262

SCHEMBL10883262

C=C1N(CCCl)c2ccc(NC(C)=O)cc2C1(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4A O75164 1/20 0.49
POLB P06746 1/20 0.49
THRB P10828 1/20 0.49
RECQL P46063 1/20 0.49
MAOA P21397 2/20 0.41
HSPA9 P38646 4/20 0.39
TP53 P04637 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MYC P01106 1/20 0.37
ALDH1A1 P00352 3/20 0.37
NQO2 P16083 2/20 0.37
HIF1A Q16665 1/20 0.37
PDK2 Q15119 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL10882763 0.89 SMN1; SMN2 (0.50) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10882193 0.86 POLB (0.49) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10883795 0.85 SMN1; SMN2 (0.46) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL4603531 0.82 MAPT (0.56) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10883259 0.77 POLB (0.47) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL6468580 0.75 NOX1 (0.50) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10882762 0.75 MEN1 (0.48) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10695610 0.75 MAPT (0.51) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10708746 0.74 MAPT (0.50) SMN1; SMN2MAPTMEN1KMT2AKDM4A
SCHEMBL10695502 0.73 MAPT (0.49) SMN1; SMN2MAPTMEN1KMT2AKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0087706-B1 CATIONIC HYDRAZONE DYES, THEIR MANUFACTURE AND THEIR USE BAYER AG (DE) 1986-07-30 EP disclosed
US-4496719-A 3H-Indol-2-yl cationic hydrazone dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1985-01-29 US disclosed
EP-0087706-A2 Cationic hydrazone dyes, their manufacture and their use BAYER AG (DE) 1983-09-07 EP disclosed