SCHEMBL7711780

SCHEMBL7711780

NC(=NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cnccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.56
POLB P06746 2/20 0.55
PSMD14 O00487 1/20 0.55
HTT P42858 1/20 0.53
KMT2A Q03164 10/20 0.53
MEN1 O00255 9/20 0.53
ALDH1A1 P00352 4/20 0.53
RAB9A P51151 1/20 0.51
TNNI3 P19429 1/20 0.45
TNNT2 P45379 1/20 0.45
TNNC1 P63316 1/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 1/20 0.45
RECQL P46063 1/20 0.45
PHGDH O43175 1/20 0.44
PKM P14618 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
BLM P54132 1/20 0.43

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
SCHEMBL7711776 1.00 MAPT (0.56) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL7717340 0.88 MAPT (0.56) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL7717337 0.88 MAPT (0.56) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL7717334 0.88 MAPT (0.56) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL6950702 0.84 ALDH1A1 (0.53) MAPTPOLBHTTKMT2AMEN1
SCHEMBL6950703 0.84 ALDH1A1 (0.53) MAPTPOLBHTTKMT2AMEN1
SCHEMBL6950706 0.84 ALDH1A1 (0.53) MAPTPOLBHTTKMT2AMEN1
SCHEMBL7719398 0.84 SMN1; SMN2 (0.42) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL7719401 0.84 SMN1; SMN2 (0.42) MAPTPOLBPSMD14HTTKMT2A
SCHEMBL7715612 0.82 MAPT (0.57) MAPTPOLBHTTKMT2AMEN1

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