SCHEMBL16624329

SCHEMBL16624329

Cc1cc(OCO)ccc1Cc1c(C)nc(N)nc1C

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
DHFR P00374 1/20 0.39
TLR7 Q9NYK1 11/20 0.36
TLR8 Q9NR97 4/20 0.36
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL16624328 0.92 NPSR1 (0.37) NPSR1DHFRTLR7TLR8KMT2A
SCHEMBL16624324 0.87 SMN1; SMN2 (0.46) NPSR1DHFRKMT2AATM
SCHEMBL16624326 0.82 KMT2A (0.44) NPSR1DHFRTLR7KMT2AATM
SCHEMBL16624354 0.81 TLR7 (0.41) NPSR1DHFRTLR7KMT2A
SCHEMBL16624319 0.78 DHFR (0.41) NPSR1DHFRTLR7TLR8
SCHEMBL16624325 0.74 NPSR1 (0.40) NPSR1DHFRTLR7TLR8
SCHEMBL16624352 0.73 DHFR (0.39) DHFRTLR7KMT2A
SCHEMBL10310939 0.72 TLR7 (0.44) NPSR1TLR7
SCHEMBL16624356 0.72 TLR7 (0.37) DHFRTLR7KMT2A
SCHEMBL16624362 0.71 HSP90AB1 (0.41) DHFR

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-20160251319-A1 CARBOXYLIC ACID COMPOUNDS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-09-01 US disclosed
US-9376398-B2 Carboxylic acid compounds SUMITOMO DAINIPPON PHARMA CO., LTD (JP) 2016-06-28 US disclosed
US-20150099770-A1 CARBOXYLIC ACID COMPOUNDS Sumitomo Pharma Co., Ltd. (JP) 2015-04-09 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 (2 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-20150099770-A1 CARBOXYLIC ACID COMPOUNDS C9, SUCNR1, C3AR1 NPSR1 1487/4885DHFR 1267/4885TLR7 87/4885
US-20160251319-A1 CARBOXYLIC ACID COMPOUNDS C9, SUCNR1, C3AR1 NPSR1 1487/4885DHFR 1267/4885TLR7 87/4885

“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.