SCHEMBL6935757

SCHEMBL6935757

CC(C)(C)N1N=C(c2ccc(Cl)cc2)C(O)(O)C1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 4/20 0.35
HPGD P15428 2/20 0.35
PGR P06401 1/20 0.34
GAA P10253 1/20 0.33
ELANE P08246 1/20 0.33
CNR1 P21554 2/20 0.33
MAPT P10636 3/20 0.33
NOTUM Q6P988 1/20 0.33
RECQL P46063 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32

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
SCHEMBL6931535 0.84 OPRL1 (0.37) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL6935411 0.82 MAOB (0.41) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6934861 0.80 KDM4E (0.39) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL6934809 0.76 ELANE (0.37) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL6931093 0.74 MAPT (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL6934453 0.74 MAPT (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL6936622 0.72 ALDH1A1 (0.44) MEN1KMT2AALDH1A1PGRMAPT
SCHEMBL6933828 0.71 COMT (0.34) ALDH1A1MAPTNOTUMSMN1; SMN2
SCHEMBL6934098 0.71 HPGD (0.41) KMT2AALDH1A1KDM4EHPGDGAA
SCHEMBL6932452 0.71 TDP1 (0.34) L3MBTL1MEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US claimed
EP-0903342-B1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics OREAL (FR) 2003-12-17 EP disclosed
US-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US disclosed
EP-0903342-A1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics L'OREAL (FR) 1999-03-24 EP disclosed