SCHEMBL11567274

SCHEMBL11567274

Nc1cc(OC(=O)O)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
DRD4 P21917 1/20 0.41
MCL1 Q07820 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KMO O15229 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL27593853 0.87 LMNA (0.47) CA12CA1CA2CA7CA9
SCHEMBL10892274 0.86 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL9163623 0.85 CYP3A4 (0.44) CA12CA1CA2CA7CA9
SCHEMBL28688992 0.85 MEN1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL7759781 0.82 NR4A1 (0.54) CA12CA9MCL1KDM4EALDH1A1
SCHEMBL10893735 0.80 KDM4E (0.49) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL1552395 0.78 MAPT (0.42) TSHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL10885773 0.78 ALDH1A1 (0.55) CA12CA1CA2CA9TP53
SCHEMBL7571192 0.78 KDM4E (0.44) TP53TSHRMCL1KDM4EALDH1A1
SCHEMBL11487438 0.77 ALDH1A1 (0.55) TP53KDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0002041-A1 Processes for synthesizing bisazomethine-bisazo pigments CIBA-GEIGY AG (CH) 1979-05-30 EP disclosed