SCHEMBL14768686

SCHEMBL14768686

COc1cc(Cl)nc(NC2CCCCC2)c1N

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 8/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
NSD2 O96028 1/20 0.45
PDGFRB P09619 3/20 0.45
PDGFRA P16234 3/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
EHMT2 Q96KQ7 2/20 0.43
EHMT1 Q9H9B1 1/20 0.43
BCL6 P41182 1/20 0.42

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
SCHEMBL14768722 0.81 KMT2A (0.44) KDM4E
SCHEMBL14768732 0.78 KMT2A (0.51) CCR4SMN1; SMN2POLBGAANSD2
SCHEMBL26111515 0.77 PDE10A (0.40) SMN1; SMN2KDM4EALDH1A1LMNAMAPT
SCHEMBL25366120 0.73 PIK3CA (0.36) ALDH1A1LMNA
SCHEMBL27191077 0.72 PDGFRB (0.51) CCR4SMN1; SMN2POLBGAANSD2
SCHEMBL25016061 0.70 BTK (0.45) GAA
SCHEMBL17122602 0.70 EHMT2 (0.76) CCR4SMN1; SMN2POLBGAANSD2
SCHEMBL15280231 0.70 EHMT2 (0.76) CCR4SMN1; SMN2POLBGAANSD2
SCHEMBL14768725 0.70 KMT2A (0.45) GAAKDM4EMAPT
SCHEMBL27196854 0.70 KMT2A (0.60) CCR4SMN1; SMN2POLBGAANSD2

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-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives Centro Nacional de Investigaceiones Oncologicas (CNIO) (ES) 2013-03-14 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-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives PIM1, PIM3, PIM2 CCR4 3808/4885SMN1; SMN2 4123/4885POLB 1747/4885

“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.