SCHEMBL7716591

SCHEMBL7716591

NC(=NN=Cc1ncc[nH]1)c1ccc(O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
MYC P01106 1/20 0.35
HTR1A P08908 3/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33

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
SCHEMBL7716585 1.00 KDM1A (0.40) KDM1ACA1CA2NPC1RAB9A
SCHEMBL7716588 1.00 KDM1A (0.40) KDM1ACA1CA2NPC1RAB9A
SCHEMBL7711768 0.87 CA1 (0.39) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL7711772 0.87 CA1 (0.39) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL7711777 0.87 CA1 (0.39) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL7717283 0.75 GRIN2D (0.61) KDM1ANPC1RAB9ASMN1; SMN2GAA
SCHEMBL7717287 0.75 GRIN2D (0.61) KDM1ANPC1RAB9ASMN1; SMN2GAA
SCHEMBL7717284 0.75 GRIN2D (0.61) KDM1ANPC1RAB9ASMN1; SMN2GAA
SCHEMBL7717329 0.73 SMN1; SMN2 (0.47) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL7717331 0.73 SMN1; SMN2 (0.47) CA1CA2NPC1RAB9ASMN1; SMN2

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