SCHEMBL8489121

SCHEMBL8489121

Cc1ccc(N2N=C(c3ccccc3)C(O)(O)C2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.40
CYP2C9 P11712 1/20 0.40
HTT P42858 1/20 0.40
CES2 O00748 2/20 0.40
MEN1 O00255 4/20 0.39
MAPT P10636 4/20 0.39
KMT2A Q03164 4/20 0.39
GAA P10253 3/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM5B Q9UGL1 1/20 0.38
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PGR P06401 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CHRM2 P08172 1/20 0.37
CYP3A4 P08684 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL6930285 0.94 SMN1; SMN2 (0.43) APPSMN1; SMN2HTTCES2MEN1
SCHEMBL6936525 0.92 GAA (0.39) APPSMN1; SMN2CES2MEN1MAPT
SCHEMBL6931466 0.91 SMN1; SMN2 (0.41) APPSMN1; SMN2HTTCES2MEN1
SCHEMBL6935197 0.87 KDM4E (0.40) APPSMN1; SMN2CYP2C9HTTMEN1
SCHEMBL6932816 0.86 CES2 (0.44) APPHTTCES2MEN1MAPT
SCHEMBL6934453 0.85 MAPT (0.43) SMN1; SMN2HTTCES2MEN1MAPT
SCHEMBL6931093 0.85 MAPT (0.43) SMN1; SMN2HTTCES2MEN1MAPT
SCHEMBL6935784 0.83 APP (0.49) APPSMN1; SMN2HTTMEN1MAPT
SCHEMBL6933095 0.82 MAPT (0.54) SMN1; SMN2CYP2C9HTTMEN1MAPT
SCHEMBL6932694 0.82 MAPT (0.42) SMN1; SMN2CYP2C9MAPTRAB9AKDM4E

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 2 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
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