SCHEMBL10312160

SCHEMBL10312160

Clc1cccc(/C=C/c2nc(Nc3cc(C4CC4)[nH]n3)nc(N3CCN(c4ccncc4)CC3)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.44
PAK4 O96013 5/20 0.43
PAK1 Q13153 5/20 0.43
IGF1R P08069 3/20 0.41
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CCNA1 P78396 1/20 0.38

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
SCHEMBL10312082 0.90 HRH4 (0.44) HRH4PAK4PAK1IGF1R
SCHEMBL16556863 0.90 IGF1R (0.41) PAK4PAK1IGF1R
SCHEMBL10312128 0.90 PAK4 (0.47) HRH4PAK4PAK1IGF1R
SCHEMBL10312196 0.89 HRH4 (0.57) HRH4PAK4PAK1IGF1R
SCHEMBL10312131 0.89 IGF1R (0.47) HRH4PAK4PAK1IGF1R
SCHEMBL10312202 0.88 PAK4 (0.45) HRH4PAK4PAK1IGF1RCCNA2
SCHEMBL10312174 0.88 HRH4 (0.46) HRH4PAK4PAK1IGF1RCCNA2
SCHEMBL10312111 0.88 HRH4 (0.48) HRH4PAK4PAK1
SCHEMBL10312117 0.86 HRH4 (0.45) HRH4PAK4PAK1IGF1RCCNA2
SCHEMBL10312170 0.86 HRH4 (0.54) HRH4PAK4PAK1IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-12 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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS STK25, STK35, SGK2 HRH4 2393/4885PAK4 254/4885PAK1 181/4885

“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.