SCHEMBL3206704

SCHEMBL3206704

Cc1cc(Cc2ccccn2)c2[nH]c(=O)[nH]c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
MAPT P10636 1/20 0.46
PNP P00491 1/20 0.44
TSHR P16473 1/20 0.39
TOP2A P11388 1/20 0.39
TOP2B Q02880 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
KCNH2 Q12809 1/20 0.38
NR3C1 P04150 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
LMNA P02545 3/20 0.36
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL3217296 0.81 ADORA1 (0.48) ADORA3ADORA2AADORA1PDE3BPDE3A
SCHEMBL3209788 0.81 KDM4E (0.42) KDM4EMAPTPNPTSHRADORA3
SCHEMBL27786274 0.69 MAPT (0.41) KDM4EMAPTPNPTSHRTOP2A
SCHEMBL4323415 0.67 PDE3B (0.43) KDM4EMAPTADORA3ADORA2AADORA1
SCHEMBL14123147 0.66 ALDH1A1 (0.58) KDM4EMAPTPNPTSHRNR3C1
SCHEMBL28343693 0.65 L3MBTL1 (0.53) MAPTTSHRALDH1A1HRH3LMNA
SCHEMBL31081656 0.64 KDM4E (0.49) KDM4EMAPTALDH1A1HRH3LMNA
SCHEMBL21142100 0.64 KDM4E (0.49) KDM4EMAPTALDH1A1HRH3LMNA
SCHEMBL9872522 0.63 ALDH1A1 (0.62) KDM4ETSHRALDH1A1HPGDLMNA
SCHEMBL14750985 0.63 ASIC3 (0.51) KDM4EMAPTALDH1A1HRH3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029710-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARy ACTIVATING ACTIVITIES PFIZER PRODUCTS INC. (US) 2010-02-04 US disclosed
EP-2125806-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES Pfizer Products Inc. (US) 2009-12-02 EP disclosed
WO-2008084303-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES PFIZER PRODUCTS INC. (US) 2008-07-17 WO 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-20100029710-A1 COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARy ACTIVATING ACTIVITIES AGTR2, AGTR1, AGT KDM4E 4566/4885MAPT 4316/4885PNP 2967/4885

“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.