SCHEMBL8075633

SCHEMBL8075633

Cc1cccc(N(C=N)c2cccc(C)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.48
TDP1 Q9NUW8 2/20 0.40
TP53 P04637 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B1 P14061 5/20 0.39
HSD17B2 P37059 5/20 0.39
NPC1 O15118 3/20 0.39
CASP3 P42574 2/20 0.39
SENP8 Q96LD8 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
SENP6 Q9GZR1 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSP90AA1 P07900 1/20 0.38
RAB9A P51151 2/20 0.36
NSD2 O96028 1/20 0.36
JAK2 O60674 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL10012179 0.80 ACHE (0.46) ACHETDP1TP53SIGMAR1ALDH1A1
SCHEMBL977663 0.75 ACHE (0.58) ACHETDP1TP53SIGMAR1ALDH1A1
SCHEMBL9216448 0.75 RAB9A (0.42) ACHETP53SIGMAR1ALDH1A1HSD17B1
SCHEMBL29381010 0.73 ALDH1A1 (0.56) ACHETDP1SIGMAR1ALDH1A1MAPK1
SCHEMBL29692933 0.73 ACHE (0.55) ACHETDP1TP53SIGMAR1ALDH1A1
SCHEMBL134721 0.73 ACHE (0.55) ACHETDP1TP53SIGMAR1ALDH1A1
SCHEMBL1697445 0.73 ACHE (0.55) ACHETDP1SIGMAR1ALDH1A1MAPK1
SCHEMBL11366275 0.73 ALDH1A1 (0.48) ACHETDP1ALDH1A1MAPK1NPC1
SCHEMBL12879 0.73 ALDH1A1 (0.56) ACHETDP1SIGMAR1ALDH1A1MAPK1
SCHEMBL11367138 0.73 ALDH1A1 (0.37) TDP1ALDH1A1HSD17B1HSD17B2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640591-B1 Azomethine derivatives as UV light absorbers ORIENT CHEMICAL IND (JP) 2000-11-02 EP disclosed
EP-0640591-A1 Azomethine derivatives as UV light absorbers ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1995-03-01 EP disclosed
US-4276295-A VASODILATORS, HYPOTENSIVE, ANTIATHEROSCLEROTIC Ishikawa, Masayuki (JP) 1981-06-30 US disclosed