SCHEMBL10477308

SCHEMBL10477308

C=CC(=O)Nc1ccccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.60
MMP2 P08253 4/20 0.60
MMP9 P14780 4/20 0.60
EGFR P00533 1/20 0.60
TGM2 P21980 1/20 0.55
CYP1A2 P05177 2/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
TEK Q02763 2/20 0.54
EPHB4 P54760 1/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
GSTO1 P78417 1/20 0.49
PTPN1 P18031 1/20 0.49
PTPN11 Q06124 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
KDM4E B2RXH2 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47

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
SCHEMBL30452125 1.00 MMP1 (0.60) MMP1MMP2MMP9EGFRTGM2
SCHEMBL8512135 0.98 MMP1 (0.58) MMP1MMP2MMP9EGFRTGM2
SCHEMBL31228347 0.86 TGM2 (0.65) EGFRTGM2GSTO1PTPN1PTPN11
SCHEMBL613090 0.86 TGM2 (0.65) EGFRTGM2GSTO1PTPN1PTPN11
SCHEMBL25289986 0.82 MAPT (0.61) HPGDKDM4ELMNAMAPT
SCHEMBL29410377 0.82 MAPT (0.61) HPGDKDM4ELMNAMAPT
SCHEMBL3823221 0.82 SMN1; SMN2 (0.48) MMP1MMP2MMP9EGFRHPGD
SCHEMBL11797598 0.81 MMP1 (0.57) MMP1MMP2MMP9EGFRCYP1A2
SCHEMBL18578322 0.80 GSTO1 (0.52) MMP1MMP2MMP9EGFRTGM2
SCHEMBL2097649 0.79 CYP1A2 (0.62) MMP1MMP2MMP9EGFRCYP1A2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116162039-A Synthesis method of visible light mediated butanediamide compound 河南师范大学 2023-05-26 CN disclosed
US-8304166-B2 Heat sensitive positive-working lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2012-11-06 US disclosed
US-8304166-B2 Heat sensitive positive-working lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2012-11-06 US disclosed
US-20100055610-A1 HEAT SENSITIVE POSITIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2010-03-04 US disclosed
US-20100055610-A1 HEAT SENSITIVE POSITIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2010-03-04 US disclosed
EP-2159049-A1 A heat-sensitive positive-working lithographic printing plate precursor Agfa Graphics N.V. (BE) 2010-03-03 EP disclosed
US-4873166-A Liquid developer for electrophotography MITSUBISHI PAPER MILLS, LTD. (JP) 1989-10-10 US disclosed
US-3974238-A CROSSLINKED POLYBUTADIENE ACUSHNET COMPANY (US) 1976-08-10 US disclosed