SCHEMBL3754341

SCHEMBL3754341

Clc1nc(NC2CC2)c2cn[nH]c2n1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.53
PLK4 O00444 2/20 0.49
PAK4 O96013 2/20 0.49
PDE2A O00408 1/20 0.45
HTR2A P28223 2/20 0.44
HTR2C P28335 1/20 0.43
SGK1 O00141 2/20 0.42
PAK1 Q13153 6/20 0.42
KMT2A Q03164 1/20 0.41
NLRP3 Q96P20 1/20 0.39
EHMT2 Q96KQ7 1/20 0.39
GRIN2B Q13224 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
SCHEMBL29705692 0.94 HPGDS (0.61) HPGDSPLK4PAK4PDE2AHTR2A
SCHEMBL22282069 0.94 HPGDS (0.61) HPGDSPLK4PAK4PDE2AHTR2A
SCHEMBL22281549 0.92 HPGDS (0.60) HPGDSPLK4PAK4PDE2AHTR2A
SCHEMBL3755106 0.88 PLK4 (0.43) HPGDSPLK4PAK4PDE2ASGK1
SCHEMBL3755112 0.88 PLK4 (0.43) HPGDSPLK4PAK4PDE2ASGK1
Hydrochloric Acid SCHEMBL22497005 0.82 PLK4 (0.47) HPGDSPLK4PAK4PDE2AHTR2A
Hydrochloric Acid SCHEMBL22497004 0.82 PLK4 (0.47) HPGDSPLK4PAK4PDE2AHTR2A
SCHEMBL13047997 0.81 BTK (0.45) PLK4PAK4SGK1PAK1
SCHEMBL8095697 0.78 PLK4 (0.55) HPGDSPLK4PAK4PDE2AHTR2A
SCHEMBL28610635 0.77 BTK (0.53) PAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-11-25 US disclosed
US-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-11-25 US disclosed
US-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-11-25 US disclosed
EP-2123654-A1 PYRAZOLOPYRIMIDINE COMPOUND Taisho Pharmaceutical Co. Ltd. (JP) 2009-11-25 EP disclosed
EP-2123654-A1 PYRAZOLOPYRIMIDINE COMPOUND Taisho Pharmaceutical Co. Ltd. (JP) 2009-11-25 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-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND SYK, LCK, FYN HPGDS 2823/4885PLK4 1106/4885PAK4 150/4885

“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.