SCHEMBL4205235

SCHEMBL4205235

CCC(C)c1c(Cl)nc(SC)nc1N1CCC(C)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 4/20 0.37
MAPT P10636 4/20 0.37
HTT P42858 1/20 0.37
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
POLB P06746 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 4/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
PKM P14618 1/20 0.33
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL3944735 0.87 HTR2A (0.39) SMN1; SMN2LMNAMAPTHTTHTR2A
SCHEMBL4192247 0.78 TRPV1 (0.34) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL4201469 0.76 L3MBTL1 (0.35) SMN1; SMN2LMNAMAPTHTTKMT2A
SCHEMBL4201476 0.75 ADORA2A (0.40) LMNAHTTKMT2AMEN1POLB
SCHEMBL4191575 0.70 LMNA (0.32) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL4194138 0.70 LMNA (0.32) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL5526686 0.70 NPSR1 (0.46) SMN1; SMN2LMNAMAPTHTTKMT2A
SCHEMBL5473951 0.70 LMNA (0.53) SMN1; SMN2LMNAMAPTHTTKMT2A
SCHEMBL4195955 0.69 LMNA (0.32) SMN1; SMN2LMNAMAPTALDH1A1L3MBTL1
SCHEMBL4196148 0.69 ADORA2A (0.38) LMNAMAPTHTTKMT2AMEN1

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 SMN1; SMN2 3171/4885LMNA 4597/4885MAPT 3707/4885

“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.