SCHEMBL9174641

SCHEMBL9174641

COc1ccc(N)c(OC)c1NC(C)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
EP300 Q09472 1/20 0.37
KAT8 Q9H7Z6 1/20 0.37
TUBB4A P04350 5/20 0.36
TUBB P07437 5/20 0.36
TUBA3C P0DPH7 5/20 0.36
TUBA1B P68363 5/20 0.36
TUBA4A P68366 5/20 0.36
TUBB4B P68371 5/20 0.36
TUBB3 Q13509 5/20 0.36
TUBB2A Q13885 5/20 0.36
TUBB8 Q3ZCM7 5/20 0.36
TUBA3E Q6PEY2 5/20 0.36
TUBA1A Q71U36 5/20 0.36
TUBA1C Q9BQE3 5/20 0.36
TUBB6 Q9BUF5 5/20 0.36
TUBB2B Q9BVA1 5/20 0.36
TUBB1 Q9H4B7 5/20 0.36
ALDH1A1 P00352 7/20 0.36
CYP3A4 P08684 3/20 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
SCHEMBL9826944 0.78 IDO1 (0.42) IDO1EP300KAT8TUBB4ATUBB
Hydrochloric Acid SCHEMBL9793088 0.77 EP300 (0.44) IDO1EP300KAT8TUBB4ATUBB
SCHEMBL27572770 0.75 KDM4E (0.49) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9176862 0.75 KDM4E (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8031008 0.73 TSHR (0.39) IDO1EP300KAT8TUBB4ATUBB
SCHEMBL94983 0.72 ALDH1A1 (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Hydrochloric Acid SCHEMBL9793148 0.72 TSHR (0.38) IDO1EP300KAT8TUBB4ATUBB
SCHEMBL5299244 0.72 SMN1; SMN2 (0.40) ALDH1A1TDP1HSD17B10MEN1MAPT
SCHEMBL1122902 0.71 IDO1 (0.50) IDO1EP300KAT8TUBB4ATUBB
SCHEMBL6138737 0.70 IDO1 (0.45) IDO1EP300KAT8TUBB4ATUBB

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-0502784-B1 Keratinous fibres dyeing process with isatin or derivatives thereof associated with a tri-, tetra- or pentasubstituted aniline or a bisphenylalkylenediamine and dyeing agents OREAL (FR) 1995-06-21 EP claimed
US-5261926-A Oxidation color dyes for hair L'OREAL (FR) 1993-11-16 US claimed
US-5261926-A Oxidation color dyes for hair L'OREAL (FR) 1993-11-16 US disclosed