SCHEMBL9523079

SCHEMBL9523079

Cc1cc(=O)n(-c2cc(C(=O)OCC3COCO3)c(Cl)cc2F)c(=O)n1C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GUSB P08236 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
GAA P10253 2/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CMA1 P23946 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL9520873 0.90 MEN1 (0.33) MEN1KMT2AGUSBBAZ2BBAZ2A
SCHEMBL9521362 0.86 HTR7 (0.40) MEN1KMT2AGAALMNAMAPT
SCHEMBL9520592 0.84 MAPT (0.32) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL9521057 0.84 GAA (0.38) GUSBBAZ2BBAZ2AGAALMNA
SCHEMBL10410194 0.83 MEN1 (0.35) MEN1KMT2AGUSBBAZ2BBAZ2A
SCHEMBL9520464 0.79 HTR3A (0.35) MEN1KMT2AGAAMAPTHPGD
SCHEMBL9521255 0.78 HPGD (0.37) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL22745804 0.78 MAPT (0.36) KMT2AGUSBBAZ2BBAZ2AGAA
SCHEMBL9522986 0.78 MAPT (0.38) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL9521382 0.78 MAPT (0.38) MEN1KMT2AMAPTHPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323487-B1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-31 EP claimed