SCHEMBL7433764

SCHEMBL7433764

O=C(O)c1ccc(N2CCCCC2)c(NC(=O)C(CS)Cc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 5/20 0.50
HPGD P15428 3/20 0.50
MAPT P10636 2/20 0.49
GAA P10253 4/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.44
KCNQ2 O43526 1/20 0.44
PKM P14618 1/20 0.44
MME P08473 3/20 0.44
ACE P12821 2/20 0.44
MAPK1 P28482 1/20 0.44
FOLH1 Q04609 1/20 0.44
ECE1 P42892 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL7440859 0.99 ALDH1A1 (0.51) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL7432199 0.90 ALDH1A1 (0.56) KMT2AALDH1A1HPGDGAAKDM4E
SCHEMBL7432434 0.85 MAPT (0.48) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL7438991 0.84 MAPT (0.49) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL7432040 0.80 KDM4E (0.54) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL7438709 0.80 MME (0.54) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL7434266 0.79 MME (0.57) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL9456711 0.79 MEN1 (0.54) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL7433690 0.77 MME (0.51) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL19084607 0.76 KDM1A (0.66) KMT2AALDH1A1HPGDMAPTGAA

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