SCHEMBL85350

SCHEMBL85350

Cc1cnc2ccnnn12

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.34
DGAT1 O75907 3/20 0.32
MKNK1 Q9BUB5 1/20 0.30

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
SCHEMBL7889526 0.68 KDM4E (0.47) MKNK1
SCHEMBL16891574 0.67 NOTUM (0.31) NOTUM
SCHEMBL15258012 0.65 BRD4 (0.43)
SCHEMBL9216298 0.65 TNF (0.53) MKNK1
SCHEMBL19153794 0.65 NOTUM (0.36) NOTUM
SCHEMBL16866294 0.63 FYN (0.61)
SCHEMBL13050513 0.63 POLB (0.35) DGAT1
SCHEMBL84743 0.62 TGFBR1 (0.35) MKNK1
SCHEMBL23176239 0.62 PDE10A (0.33) DGAT1
SCHEMBL266452 0.62 DGAT1 (0.41) DGAT1MKNK1

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-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-31 US disclosed
US-8131527-B1 FGFR pharmacophore compounds ASTEX THERAPEUTICS LTD. (GB) 2012-03-06 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-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES C1R, C9, C1S NOTUM 952/4885DGAT1 3961/4885MKNK1 4787/4885

“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.