SCHEMBL9811413

SCHEMBL9811413

CC(=O)C1C(=O)N(Cc2ccccc2)C1CCOCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
EHMT2 Q96KQ7 1/20 0.40
ELANE P08246 4/20 0.39
HSD11B1 P28845 1/20 0.39
AGTR2 P50052 1/20 0.38
BRD4 O60885 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL9811417 1.00 ALDH1A1 (0.40) ALDH1A1EHMT2ELANEHSD11B1AGTR2
SCHEMBL9811411 1.00 ALDH1A1 (0.40) ALDH1A1EHMT2ELANEHSD11B1AGTR2
SCHEMBL9811337 0.81 EHMT2 (0.42) ALDH1A1EHMT2HSD11B1MEN1KMT2A
SCHEMBL11028601 0.79 EHMT2 (0.42) EHMT2AGTR2MEN1KMT2A
SCHEMBL9814365 0.79 ELANE (0.41) EHMT2ELANEAGTR2MEN1KMT2A
SCHEMBL9811335 0.79 ELANE (0.41) EHMT2ELANEAGTR2MEN1KMT2A
SCHEMBL9811457 0.78 GHSR (0.40) ALDH1A1EHMT2ELANEHSD11B1
SCHEMBL9811470 0.78 GHSR (0.40) ALDH1A1EHMT2ELANEHSD11B1
SCHEMBL9811450 0.78 GHSR (0.40) ALDH1A1EHMT2ELANEHSD11B1
SCHEMBL9811384 0.75 EHMT2 (0.38) ALDH1A1EHMT2ELANEHSD11B1BRD4

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-0223588-B1 PROCESS FOR THE PREPARATION OF BETA-LACTAM COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-12 EP disclosed
EP-0223588-A1 Process for the preparation of beta-lactam compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-05-27 EP disclosed