SCHEMBL3606061

SCHEMBL3606061

Cc1c(N)ccc(=O)n1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 3/20 0.42
CA12 O43570 1/20 0.39
BRD4 O60885 1/20 0.39
CA9 Q16790 1/20 0.39
KAT2B Q92831 1/20 0.39
BRD9 Q9H8M2 1/20 0.39
ATAD2 Q6PL18 1/20 0.38
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 2/20 0.36
HPGD P15428 2/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 3/20 0.35
BCHE P06276 1/20 0.33
PTGS2 P35354 1/20 0.33
NOX4 Q9NPH5 1/20 0.33
ADORA2A P29274 1/20 0.33
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32

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
SCHEMBL10314053 0.75 BRPF1 (0.41) BRPF1CA12BRD4CA9KAT2B
SCHEMBL22224593 0.71 BRPF1 (0.39) BRPF1CA12BRD4CA9KAT2B
SCHEMBL2116417 0.71 BRPF1 (0.39) BRPF1CA12BRD4CA9KAT2B
SCHEMBL17237899 0.70 MAPT (0.39) BRPF1CA12BRD4CA9KAT2B
SCHEMBL23371755 0.70 BRPF1 (0.38) BRPF1CA12BRD4CA9KAT2B
Hydrochloric Acid SCHEMBL19815770 0.69 MAPT (0.38) BRPF1CA12BRD4CA9KAT2B
SCHEMBL18368365 0.68 ALDH1A1 (0.38) BRPF1CA12BRD4CA9KAT2B
SCHEMBL15804043 0.67 ATAD2 (0.38) BRPF1ATAD2KDM4EALDH1A1HPGD
SCHEMBL25303112 0.67 BRPF1 (0.39) BRPF1BRD4KDM4EALDH1A1CYP1A2
SCHEMBL17560670 0.66 BRPF1 (0.46) BRPF1CA12BRD4CA9KAT2B

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-20100022582-A1 Tetrahydroisoquinoline Compound and Medicinal Use Thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2010-01-28 US disclosed
EP-1857444-A1 TETRAHYDROISOQUINOLINE COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2007-11-21 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-20100022582-A1 Tetrahydroisoquinoline Compound and Medicinal Use Thereof ACAT1, ACAT2, LCAT BRPF1 3730/4885CA12 2370/4885BRD4 522/4885

“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.