SCHEMBL3600873

SCHEMBL3600873

Nc1ccc2c(c1)NC(=O)CS2(=O)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.61
CA9 Q16790 4/20 0.50
CA2 P00918 3/20 0.42
CA12 O43570 3/20 0.39
KDM4E B2RXH2 3/20 0.38
GAA P10253 3/20 0.38
MAPT P10636 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CASP1 P29466 1/20 0.38
RECQL P46063 1/20 0.38
CASP7 P55210 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA1 P00915 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CDK5 Q00535 2/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
CCNB2 O95067 1/20 0.35

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
SCHEMBL3598842 0.86 PLCG1 (0.61) PLCG1CA9CA2CA12KDM4E
SCHEMBL10420771 0.82 PLCG1 (0.61) PLCG1CA9CA2CA12CA1
SCHEMBL12060281 0.81 PLCG1 (0.59) PLCG1CA9CA2CA12KDM4E
SCHEMBL3600870 0.81 PLCG1 (0.59) PLCG1CA9CA2AHRCMA1
SCHEMBL14476022 0.78 PLCG1 (0.56) PLCG1CA2KDM4EGAAHSD17B10
SCHEMBL13545257 0.77 PLCG1 (0.54) PLCG1CA9CA2CA12CA1
SCHEMBL19307964 0.77 PLCG1 (0.54) PLCG1CA9CA2GAAMAPT
SCHEMBL14476029 0.77 PLCG1 (0.54) PLCG1CA9CA2CA12GAA
SCHEMBL10422692 0.77 PLCG1 (0.54) PLCG1CA2CA1CDK5CCNB2
SCHEMBL13369187 0.77 PLCG1 (0.54) PLCG1CA2KDM4EGAAMAPT

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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP disclosed
US-4960870-A DYEING WOOL, POLYAMIDES; FIBER REACTIVE DYES CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 PLCG1 4081/4885CA9 1531/4885CA2 887/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.