SCHEMBL7433690

SCHEMBL7433690

Cc1cc(C(=O)O)ccc1NC(=O)C(CS)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.51
ACE P12821 3/20 0.50
ALDH1A1 P00352 2/20 0.50
FOLH1 Q04609 2/20 0.50
HPGD P15428 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
ECE1 P42892 1/20 0.50
BLM P54132 1/20 0.50
NPEPPS P55786 1/20 0.50
KMT2A Q03164 1/20 0.50
THRB P10828 1/20 0.49
CPA3 P15088 1/20 0.48

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
SCHEMBL7434266 0.90 MME (0.57) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7438709 0.84 MME (0.54) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7429336 0.84 CYP1A2 (0.50) MMEACEALDH1A1MAPTTHRB
SCHEMBL9456711 0.83 MEN1 (0.54) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7434110 0.82 LTB4R (0.53) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7425843 0.81 MME (0.54) MMEACEALDH1A1FOLH1HPGD
SCHEMBL390864 0.79 MME (0.57) MMEACEALDH1A1FOLH1HPGD
SCHEMBL391430 0.79 FOLH1 (0.60) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7427956 0.78 MME (0.51) MMEACEALDH1A1FOLH1HPGD
SCHEMBL7434454 0.78 FOLH1 (0.59) MMEACEALDH1A1FOLH1HPGD

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