SCHEMBL7807692

SCHEMBL7807692

Cn1cccc1-c1cc(N)ccc1NCCO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
FCGR3B O75015 1/20 0.31
FCGR1A P12314 1/20 0.31
FCGR2A P12318 1/20 0.31
CDK1 P06493 1/20 0.31
TOP2B Q02880 1/20 0.31
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PRKCI P41743 1/20 0.30
BRD4 O60885 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
RECQL P46063 1/20 0.30
EGFR P00533 1/20 0.30

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
SCHEMBL7807390 0.92 ADRA1D (0.36) ADRA1DADRA1AKDM4EHSD17B10BRD4
SCHEMBL7805924 0.85 PTGER4 (0.41) ADRA1DADRA1ACYP2C19KDM4EALDH1A1
SCHEMBL7807674 0.85 ADRA1D (0.33) ADRA1DADRA1A
SCHEMBL7808816 0.82 PTGER4 (0.40) ADRA1DADRA1AMAPK1HSD17B10ALDH1A1
SCHEMBL7800934 0.82 ADRA1D (0.34) ADRA1DADRA1AMAPK1
SCHEMBL7812485 0.80 PRKCI (0.35) ADRA1DADRA1AKDM4EMAPK1PRKCI
SCHEMBL7808724 0.76 EGFR (0.34) ADRA1DADRA1ACYP2C19KDM4ECDK1
SCHEMBL7460027 0.76 CYP2C19 (0.32) CYP2C19KDM4EGLACDK1ALDH1A1
SCHEMBL6570922 0.75 PTGDR2 (0.44) CYP2C19KDM4EGLATOP2BMAPK1
SCHEMBL6571957 0.75 PRSS1 (0.38) KDM4EFCGR3BFCGR1AFCGR2ATOP2B

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-0943614-B1 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives WELLA AG (DE) 2001-12-12 EP disclosed
US-6042620-A FOR DYEING KERATIN FIBERS SUCH AS HAIR WELLA AG (DE) 2000-03-28 US disclosed
EP-0943614-A2 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives Wella Aktiengesellschaft (DE) 1999-09-22 EP disclosed