SCHEMBL7459664

SCHEMBL7459664

Cc1ccc(NCc2cscc2-c2cc(N)ccc2N)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
NPC1 O15118 6/20 0.37
RAB9A P51151 5/20 0.37
LMNA P02545 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 6/20 0.37
GAA P10253 6/20 0.36
TDP1 Q9NUW8 3/20 0.36
KDM4E B2RXH2 3/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
KMT2A Q03164 2/20 0.36
ALOX15 P16050 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
Hydrochloric Acid SCHEMBL7456853 0.99 MAPT (0.42) MAPTNPC1RAB9ALMNAL3MBTL1
SCHEMBL7461663 0.86 MAPT (0.37) MAPTL3MBTL1ALDH1A1TDP1MEN1
Hydrochloric Acid SCHEMBL7455759 0.85 MAPT (0.36) MAPTL3MBTL1ALDH1A1TDP1MEN1
SCHEMBL7451451 0.82 NPC1 (0.40) MAPTNPC1RAB9ACYP1A2CYP2D6
SCHEMBL7459718 0.82 KDM4E (0.47) MAPTL3MBTL1ALDH1A1GAATDP1
SCHEMBL7460493 0.82 ADRA2B (0.37) MAPTLMNAL3MBTL1CYP1A2CYP3A4
SCHEMBL7456555 0.81 APP (0.40) MAPTNPC1RAB9ALMNAL3MBTL1
SCHEMBL7451416 0.81 CA1 (0.37) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL7452886 0.81 ADRA2B (0.33) MAPTNPC1RAB9ALMNAL3MBTL1
SCHEMBL7455072 0.81 RPS6KA2 (0.46) MAPTNPC1RAB9AL3MBTL1ALDH1A1

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 5 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 claimed
EP-0963982-A2 New diaminobenzene derivatives and these componends containing colouring agents Wella Aktiengesellschaft (DE) 1999-12-15 EP claimed
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