SCHEMBL7433301

SCHEMBL7433301

Cc1cc(NC(=O)C(CS)CC(C)C)cc(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
POLB P06746 1/20 0.41
TPMT P51580 1/20 0.41
LMNA P02545 1/20 0.39
HCAR1 Q9BXC0 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
MME P08473 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
SCHEMBL7429627 0.83 MEN1 (0.49) MEN1KMT2AHTTNPSR1POLB
SCHEMBL7426722 0.82 ALDH1A1 (0.54) MEN1KMT2APOLBLMNA
SCHEMBL7427956 0.81 MME (0.51) MEN1KMT2AMME
SCHEMBL10438797 0.81 CA1 (0.49) MEN1KMT2AHTTNPSR1CA1
SCHEMBL7424237 0.78 MEN1 (0.44) MEN1KMT2AHTTNPSR1POLB
SCHEMBL7424227 0.77 MEN1 (0.48) MEN1KMT2AHTTNPSR1MME
Hydrochloric Acid SCHEMBL9456684 0.76 MEN1 (0.47) MEN1KMT2AHTTNPSR1MME
SCHEMBL7436410 0.75 MEN1 (0.52) MEN1KMT2AHTTNPSR1POLB
SCHEMBL7436416 0.71 MEN1 (0.42) MEN1KMT2AHTTNPSR1POLB
SCHEMBL7427961 0.70 ALDH1A1 (0.44) MEN1KMT2AHTTNPSR1POLB

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
US-5210266-A Analgesic enkephalinase inhibitors DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1993-05-11 US disclosed
US-5179125-A Analgesics DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1993-01-12 US disclosed
EP-0318859-A2 N-substituted mercaptopropanamide derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1989-06-07 EP disclosed