SCHEMBL1613592

SCHEMBL1613592

COc1ccc(-c2cc(=O)n3nc(C)c(-c4cccc5ccccc45)c3[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
MAPT P10636 6/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
CASP3 P42574 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
SENP8 Q96LD8 1/20 0.41
PARP1 P09874 3/20 0.41
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL1614570 0.90 ADORA2A (0.40) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL1614156 0.88 KMT2A (0.39) KDM4ESMN1; SMN2ALDH1A1HPGDADORA3
SCHEMBL1278880 0.87 ENPP1 (0.44) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL1614653 0.86 PDGFRB (0.48) KDM4ESMN1; SMN2LMNAMAPTPARP1
SCHEMBL19084584 0.84 PSD (0.54) KDM4ESMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL1614079 0.84 MAPT (0.51) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL13516076 0.84 MAPT (0.51) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL1614119 0.81 DHFR (0.40) KDM4ESMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL1614608 0.80 PSD (0.47) SMN1; SMN2ALDH1A1MAPTRAB9ANPC1
SCHEMBL1614238 0.80 KCNQ3 (0.38) KDM4EGAAPLAT

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-8796285-B2 Pyrazolo [1,5-a]-pyrimidones derivatives and pharmaceutical compositions and uses thereof HEBEI MEDICAL UNIVERSITY (CN) 2014-08-05 US disclosed
US-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof PEKING UNIVERSITY (CN) 2012-04-12 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-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof KCNJ2, KCNQ5, KCNJ11 KDM4E 1364/4885SMN1; SMN2 2476/4885LMNA 2076/4885

“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.