SCHEMBL7808598

SCHEMBL7808598

COCCCNc1ccc(N)c(-c2cccs2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
HDAC2 Q92769 6/20 0.39
HDAC1 Q13547 5/20 0.39
HPGD P15428 3/20 0.38
RAB9A P51151 1/20 0.38
HTT P42858 1/20 0.38
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPC1 O15118 1/20 0.37
PPARG P37231 1/20 0.37
KCNH2 Q12809 1/20 0.36
HDAC3 O15379 4/20 0.36
C5AR1 P21730 1/20 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
SCHEMBL7805917 0.92 LMNA (0.42) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL7805996 0.83 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AHDAC2HDAC1
SCHEMBL7805911 0.80 ADORA1 (0.43) GAAALDH1A1KDM4EMAPTHDAC2
SCHEMBL7806017 0.78 GAA (0.41) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL7462786 0.78 HDAC1 (0.39) MEN1KMT2AMAPTHDAC2HDAC1
SCHEMBL7805938 0.75 KCNH2 (0.46) KDM4EMEN1KMT2AMAPTHDAC2
SCHEMBL7800808 0.75 ADORA2A (0.41) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL7808514 0.75 AXL (0.36) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL7807480 0.74 NPC1 (0.39) GAAALDH1A1KDM4ELMNAMAPT
SCHEMBL7807634 0.74 KCNH2 (0.35) HDAC2HDAC1KCNH2HDAC3C5AR1

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