SCHEMBL7717340

SCHEMBL7717340

NC(=NN=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cnccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.56
MEN1 O00255 9/20 0.56
KMT2A Q03164 9/20 0.56
ALDH1A1 P00352 5/20 0.56
HPGD P15428 2/20 0.56
LMNA P02545 1/20 0.56
ALOX12 P18054 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MAPK1 P28482 2/20 0.52
HTT P42858 4/20 0.51
POLB P06746 3/20 0.49
RAB9A P51151 2/20 0.49
CTDSP1 Q9GZU7 2/20 0.49
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MCL1 Q07820 2/20 0.49
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL7717337 1.00 MAPT (0.56) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7717334 1.00 MAPT (0.56) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7711780 0.88 MAPT (0.56) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7711776 0.88 MAPT (0.56) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7717773 0.83 KDM4E (0.48) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7717775 0.83 KDM4E (0.48) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7717776 0.83 KDM4E (0.48) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7715615 0.81 MAPT (0.57) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7715608 0.81 MAPT (0.57) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL7715612 0.81 MAPT (0.57) MAPTMEN1KMT2AALDH1A1HPGD

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-6379655-B1 FOR PROTECTION OF HUMAN SKIN AND/OR HAIR AGAINST THE DAMAGING EFFECTS OF ULTRAVIOLET IRRADIATION SOCIETE L'OREAL S.A. (FR) 2002-04-30 US claimed
US-6379655-B1 FOR PROTECTION OF HUMAN SKIN AND/OR HAIR AGAINST THE DAMAGING EFFECTS OF ULTRAVIOLET IRRADIATION SOCIETE L'OREAL S.A. (FR) 2002-04-30 US disclosed