SCHEMBL7459974

SCHEMBL7459974

COCCN(CCOC)c1ccc(N)c(-c2ccsc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
CYP2A6 P11509 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SLC6A9 P48067 1/20 0.33
BACE1 P56817 1/20 0.33
KDR P35968 2/20 0.33
GFER P55789 1/20 0.33
TDO2 P48775 1/20 0.33
IMPDH2 P12268 1/20 0.32
S100B P04271 1/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
CHEK2 O96017 1/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 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
SCHEMBL7462791 0.88 KCNH2 (0.38) KCNH2CYP2A6MEN1KMT2AUSP2
SCHEMBL7461916 0.82 KCNH2 (0.41) KCNH2CYP2A6MEN1KMT2AUSP2
SCHEMBL6571429 0.81 ALDH1A1 (0.36) MEN1KMT2AMAPTALOX15HSD17B10
SCHEMBL6573501 0.81 S100B (0.35) S100B
SCHEMBL6570799 0.80 GRM2 (0.38) S100BHDAC1
SCHEMBL6570859 0.80 S100B (0.37) MEN1KMT2AMAPTALOX15HSD17B10
SCHEMBL6572008 0.80 MAPT (0.35) USP2MAPTALOX15HSD17B10S100B
SCHEMBL6571984 0.78 S100B (0.36) MEN1KMT2AMAPTHSD17B10S100B
SCHEMBL6571056 0.78 MGAM (0.36) MEN1KMT2AS100BCHEK2FYN
SCHEMBL6574728 0.78 KMT2A (0.41) MEN1KMT2AS100B

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-0963982-B1 New diaminobenzene derivatives and these componends containing colouring agents WELLA AG (DE) 2002-03-13 EP disclosed
US-6132475-A FOR OXIDATION DYEING OF KERATIN FIBERS; INCLUDES COUPLER AND DEVELOPER, IN WHICH THE DEVELOPER IS A SUBSTITUTED 2-(FURYL, THIENYL, PYRROLYL, OR SELENOPHENE) P-DIAMINOBENZENE DERIVATIVE OF GIVEN FORMULA; COLORFASTNESS, WASHFASTNESS WELLA AKTIENGESELLSCHAFT (DE) 2000-10-17 US disclosed
EP-0963982-A2 New diaminobenzene derivatives and these componends containing colouring agents Wella Aktiengesellschaft (DE) 1999-12-15 EP disclosed