SCHEMBL4192247

SCHEMBL4192247

CCC(C)c1c(Cl)nc(S(C)(=O)=O)nc1N1CCC(C)CC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.34
CASP7 P55210 2/20 0.34
BRCA1 P38398 1/20 0.34
TSHR P16473 3/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 4/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PKM P14618 1/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CASP1 P29466 1/20 0.31

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
SCHEMBL3943563 0.88 POLB (0.36) TRPV1CASP7BRCA1TSHRPOLB
SCHEMBL4205235 0.78 SMN1; SMN2 (0.37) TSHRPOLBSMN1; SMN2TDP1ALDH1A1
SCHEMBL4191507 0.73 NPC1 (0.33) SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL4201476 0.73 ADORA2A (0.40) TRPV1TSHRPOLBALDH1A1MEN1
SCHEMBL5525205 0.71 NPSR1 (0.44) CASP7BRCA1TSHRPOLBSMN1; SMN2
SCHEMBL5474300 0.71 TSHR (0.41) CASP7BRCA1TSHRPOLBSMN1; SMN2
SCHEMBL4197196 0.69 ADORA2A (0.36) TRPV1CASP7BRCA1TSHRPOLB
SCHEMBL4197121 0.68 SMN1; SMN2 (0.40) POLBSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL3944735 0.64 HTR2A (0.39) TSHRPOLBSMN1; SMN2TDP1ALDH1A1
SCHEMBL4195166 0.63 GLP1R (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042917-A1 Aminopyrimidine Derivative and Plant Disease Control Agent for Agricultural or Horticultural Use KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2009-02-12 US disclosed
EP-2006288-A1 AMINOPYRIDINE DERIVATIVE AND PLANT DISEASE CONTROL AGENT FOR AGRICULTURAL OR HORTICULTURAL USE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2008-12-24 EP 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-20090042917-A1 Aminopyrimidine Derivative and Plant Disease Control Agent for Agricultural or Horticultural Use DPYD, PM20D2, PDCD11 TRPV1 4718/4885CASP7 1329/4885BRCA1 762/4885

“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.