SCHEMBL30733946

SCHEMBL30733946

Oc1c(Cc2ccccc2)nc2ccccn12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.49
ABCB1 P08183 1/20 0.47
PTPN1 P18031 1/20 0.46
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HIF1A Q16665 1/20 0.43
EPAS1 Q99814 1/20 0.43
ATM Q13315 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
ADORA2A P29274 2/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
RXFP1 Q9HBX9 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
SCHEMBL13081115 0.79 KDM4E (0.49) PLAUKDM4EALDH1A1HPGDNPC1
SCHEMBL29967412 0.78 KDM5A (0.41) PLAUABCB1PTPN1KDM4EHPGD
SCHEMBL3155940 0.73 ENPP2 (0.54) PLAUKDM4EALDH1A1HPGDGLA
SCHEMBL24697550 0.72 KDM4E (0.56) KDM4EALDH1A1HPGDNPC1GLA
SCHEMBL14624148 0.70 NPC1 (0.64) KDM4EALDH1A1HPGDNPC1GLA
SCHEMBL20798092 0.70 KDM4E (0.66) PTPN1KDM4EALDH1A1HPGDNPC1
SCHEMBL20798147 0.70 ADCY10 (0.56) PLAUPTPN1KDM4EALDH1A1HPGD
SCHEMBL21387446 0.70 AGTR1 (0.51) PLAUABCB1KDM4EALDH1A1HPGD
SCHEMBL30714859 0.70 ADCY10 (0.53) KDM4EALDH1A1HPGDNPC1GAA
SCHEMBL10424639 0.69 KMT2A (0.59) KDM4EALDH1A1HPGDNPC1GLA

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-20240228487-A1 FUSED HETEROCYCLIC COMPOUND AND APPLICATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND APPLICATION THEREOF ZHEJIANG UNIVERSITY (CN) 2024-07-11 US disclosed
EP-4306522-A1 FUSED RING HETEROCYCLIC COMPOUND AND APPLICATION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND APPLICATION THEREOF Zhejiang University (CN) 2024-01-17 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-20240228487-A1 FUSED HETEROCYCLIC COMPOUND AND APPLICATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND APPLICATION THEREOF TRPM2, TRPM8, TRPM7 PLAU 1784/4885ABCB1 88/4885PTPN1 2632/4885

“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.