SCHEMBL9502968

SCHEMBL9502968

CC(=O)Nc1ccc2c(c1)C(=O)OC2(Cl)Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 1/20 0.58
MAOA P21397 3/20 0.51
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PDK2 Q15119 2/20 0.49
CYP1A2 P05177 2/20 0.44
ADRA2A P08913 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR2C P28335 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR2B P41595 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 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
SCHEMBL543293 0.74 FTO (1.00) FTOALDH1A1MEN1MAPTKMT2A
SCHEMBL29938908 0.74 FTO (1.00) FTOALDH1A1MEN1MAPTKMT2A
SCHEMBL15799957 0.73 FTO (0.52) FTOMAOAALDH1A1MEN1NPC1
SCHEMBL1566252 0.71 MAOA (0.65) FTOMAOAALDH1A1MEN1NPC1
SCHEMBL10013901 0.70 FTO (0.74) FTOMAOAALDH1A1MEN1NPC1
SCHEMBL2195036 0.70 ALDH1A1 (0.72) MAOAALDH1A1MEN1NPC1MAPT
SCHEMBL13165575 0.69 ALDH1A1 (0.67) MAOAALDH1A1MEN1NPC1MAPT
SCHEMBL22321720 0.69 MAOA (0.83) MAOAALDH1A1MEN1NPC1MAPT
SCHEMBL4291944 0.69 MAOA (0.89) MAOAALDH1A1MEN1NPC1MAPT
SCHEMBL5838218 0.68 ALDH1A1 (0.69) MAOAALDH1A1MEN1NPC1MAPT

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-0377406-B1 PRESSURE-SENSITIVE OR HEAT-SENSITIVE RECORDING MATERIAL CIBA-GEIGY AG (CH) 1993-06-09 EP disclosed
US-5013707-A Pressure- or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1991-05-07 US disclosed
EP-0377406-A1 Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY AG (CH) 1990-07-11 EP disclosed