SCHEMBL5713592

SCHEMBL5713592

Cc1ccc(NCc2cccc(Cl)c2)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52
TUBA1B P68363 1/20 0.52
TUBA4A P68366 1/20 0.52
TUBB4B P68371 1/20 0.52
TUBB3 Q13509 1/20 0.52
TUBB2A Q13885 1/20 0.52
TUBB8 Q3ZCM7 1/20 0.52
TUBA3E Q6PEY2 1/20 0.52
TUBA1A Q71U36 1/20 0.52
TUBA1C Q9BQE3 1/20 0.52
TUBB6 Q9BUF5 1/20 0.52
TUBB2B Q9BVA1 1/20 0.52
TUBB1 Q9H4B7 1/20 0.52
ARG1 P05089 1/20 0.49
EGFR P00533 2/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL5713517 0.83 TUBB4A (0.58) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5713616 0.82 ARG1 (0.70) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5713600 0.82 FFAR1 (0.52) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5713621 0.80 MAPT (0.71) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8234606 0.80 HTT (0.62) MAPTMEN1KMT2AMAOBNPC1
SCHEMBL5713700 0.79 LRRK2 (0.49) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL6700054 0.79 CHRM2 (0.55) MAPTEGFRMEN1KMT2AMAOB
SCHEMBL632217 0.79 CHRM2 (0.55) MAPTEGFRMEN1KMT2AMAOB
SCHEMBL5713561 0.78 ARG1 (0.54) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL11510712 0.77 HDAC4 (0.54) MEN1KMT2AMAOBNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1251822-A4 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P & G CLAIROL INC (US) 2006-05-31 EP disclosed
CN-1196464-C Novel couplers for oxidative hair dyeing P & G CLAROR INC (US) 2005-04-13 CN disclosed
US-6540793-B1 Coupler for use in oxidative hair dyeing CLAIROL INCORPORATED 2003-04-01 US disclosed
CN-1396819-A Novel couplers for oxidative hair dyeing P & G CLAROR INC (US) 2003-02-12 CN disclosed
EP-1251822-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING Clairol Incorporated (US) 2002-10-30 EP disclosed
WO-2001056538-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G-CLAIROL, INC. (US) 2001-08-09 WO disclosed