SCHEMBL21233732

SCHEMBL21233732

CC(C)(C)OC(=O)NCCCCCCN1N=C(c2ccc(NC(=O)N3Cc4ccncc4C3)cc2)CC(c2cccc3ncccc23)(C(F)(F)F)C1=O

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 19/20 0.41
ROCK2 O75116 1/20 0.37

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
SCHEMBL22664226 0.99 NAMPT (0.41) NAMPTROCK2
SCHEMBL21223796 0.92 NAMPT (0.41) NAMPTROCK2
SCHEMBL28565565 0.91 NAMPT (0.42) NAMPTROCK2
SCHEMBL21233714 0.91 NAMPT (0.39) NAMPTROCK2
SCHEMBL21223958 0.89 NAMPT (0.41) NAMPTROCK2
SCHEMBL21225889 0.88 NAMPT (0.42) NAMPTROCK2
SCHEMBL22664258 0.83 NAMPT (0.41) NAMPTROCK2
SCHEMBL22664238 0.82 NAMPT (0.41) NAMPTROCK2
SCHEMBL22923503 0.82 NAMPT (0.49) NAMPT
SCHEMBL20159476 0.80 NAMPT (0.49) NAMPT

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-20200360531-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2020-11-19 US disclosed
WO-2019149637-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2019-08-08 WO 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-20200360531-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS NAMPT, B3GNT2, NQO1 NAMPT 1/4885ROCK2 1686/4885

“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.