SCHEMBL6515933

SCHEMBL6515933

Cc1cc(O)ccc1NCCO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ GAA P10253 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ CYP3A4 P08684 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ MAPT P10636 4/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ RUNX1 Q01196 1/20 0.44
▸ CBFB Q13951 1/20 0.44
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CYTH2 Q99418 1/20 0.42
▸ AR P10275 1/20 0.41

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
SCHEMBL16900566 0.85 CYP3A4 (0.52) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL459121 0.85 CYP3A4 (0.67) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL3875798 0.82 KMT2A (0.60) KDM4EALDH1A1GAAHPGDTSHR
SCHEMBL10476380 0.81 ALDH1A1 (0.56) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL7176594 0.81 KMT2A (0.42) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL8996566 0.80 MAPT (0.49) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL20612556 0.80 CYP3A4 (0.71) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL30991860 0.80 CYP3A4 (0.71) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL29392615 0.79 CYP2C19 (0.45) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL33660 0.79 CYP2C19 (0.45) KDM4EALDH1A1GAAHPGDGLA

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-0985538-B1 Ink jet printing process XEROX CORP (US) 2005-12-14 — — EP disclosed
US-6312121-B1 Ink jet printing process XEROX CORPORATION 2001-11-06 — — US disclosed
EP-0985538-A2 Ink jet printing process XEROX CORPORATION (US) 2000-03-15 — — EP disclosed
EP-0331144-B1 3-SUBSTITUTED PARA-AMINO PHENOLS, PROCESS FOR THEIR PREPARATION, THEIR USE IN DYEING KERATENIC FIBRES AND INTERMEDIATES USED IN THE PREPARATION PROCESS L'OREAL (FR) 1993-06-09 — — EP disclosed
EP-0331144-A2 3-Substituted para-amino phenols, process for their preparation, their use in dyeing keratenic fibres and intermediates used in the preparation process L'OREAL (FR) 1989-09-06 — — EP disclosed
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