SCHEMBL7299362

SCHEMBL7299362

COC(=O)c1c(C(=O)c2ccccc2Cl)c(C)n(NC(=O)OC(C)(C)C)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
GAA P10253 3/20 0.38
ATR Q13535 1/20 0.37
BTK Q06187 2/20 0.37
TSHR P16473 2/20 0.37
HTT P42858 1/20 0.37
F2 P00734 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
GLA P06280 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7291428 0.81 HPGD (0.50) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL7296614 0.78 ALDH1A1 (0.47) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL7291292 0.76 AR (0.40) KMT2AMAPTALDH1A1GAAL3MBTL1
SCHEMBL6183437 0.71 CA12 (0.58) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL10717542 0.70 ALDH1A1 (0.62) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL10743471 0.69 LMNA (0.51) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL4707412 0.69 RXFP1 (0.50) HPGDKMT2AMAPTLMNABTK
SCHEMBL27806654 0.68 CES2 (0.52) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL22195276 0.67 KMT2A (0.36) HPGDKMT2AMAPTALDH1A1LMNA
SCHEMBL31444308 0.66 KCNA5 (0.51) KMT2AALDH1A1LMNABTKTSHR

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
EP-0300688-A1 Pyrrole derivatives, process for their preparation and pharmaceutical compositions containing them FISONS plc (GB) 1989-01-25 EP claimed
EP-0300688-A1 Pyrrole derivatives, process for their preparation and pharmaceutical compositions containing them FISONS plc (GB) 1989-01-25 EP disclosed