SCHEMBL4099539

SCHEMBL4099539

CCc1cc(-c2ccc(C(=O)CCC(=O)NCCc3cccnc3)cc2)ccc1OC

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.64
PTAFR P25105 9/20 0.56
TLR7 Q9NYK1 1/20 0.51
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
MAPK1 P28482 1/20 0.48
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NAMPT P43490 1/20 0.46

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
SCHEMBL4085974 0.91 HSD17B1 (0.52) HSD17B1PTAFRTLR7KMT2AMEN1
SCHEMBL4094282 0.91 HSD17B1 (0.77) HSD17B1PTAFRKMT2AMEN1USP2
SCHEMBL4094136 0.88 HSD17B1 (0.82) HSD17B1PTAFRTLR7KMT2AMEN1
SCHEMBL4102741 0.85 HSD17B1 (0.65) HSD17B1PTAFRTLR7MAPK1USP2
SCHEMBL4100708 0.83 HSD17B1 (0.62) HSD17B1MAPK1USP2ALDH1A1NPSR1
SCHEMBL4085481 0.82 MAPT (0.47) HSD17B1TLR7KMT2AMEN1ALDH1A1
SCHEMBL4093397 0.80 TP53 (0.48) HSD17B1KMT2AMEN1
SCHEMBL4101406 0.80 HSD17B1 (0.61) HSD17B1KMT2AMEN1MAPK1USP2
SCHEMBL4093157 0.79 LMNA (0.61) HSD17B1PTAFRKMT2AUSP2
SCHEMBL4093511 0.79 HSD17B1 (0.67) HSD17B1PTAFRTLR7KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090186900-A1 COMPOUND STERIX LIMITED (GB) 2009-07-23 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-20090186900-A1 COMPOUND HSD17B2, HSD17B11, CYP17A1 HSD17B1 4/4885PTAFR 3930/4885TLR7 4630/4885

“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.