SCHEMBL21225908

SCHEMBL21225908

O=C(Nc1ccc(C2=NNC(=O)C(c3cccc4ncccc34)(C(F)(F)F)C2)cc1)N1Cc2ccncc2C1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.47
NAMPT P43490 19/20 0.43

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
SCHEMBL21222803 1.00 ROCK2 (0.47) ROCK2NAMPT
SCHEMBL21222835 0.84 IGF1R (0.36)
SCHEMBL21222793 0.84 IGF1R (0.36)
SCHEMBL21225889 0.82 NAMPT (0.42) ROCK2NAMPT
SCHEMBL21223958 0.81 NAMPT (0.41) ROCK2NAMPT
SCHEMBL28565565 0.80 NAMPT (0.42) ROCK2NAMPT
SCHEMBL21234153 0.79 PDE3B (0.34)
SCHEMBL21233809 0.79 ACVR1 (0.31)
SCHEMBL21225886 0.77 ACVR1 (0.34)
SCHEMBL21234034 0.77 ACVR1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3746079-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS Bayer Aktiengesellschaft (DE) 2020-12-09 EP claimed
US-20200360531-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2020-11-19 US claimed
WO-2019149637-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2019-08-08 WO claimed
EP-3746079-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS Bayer Aktiengesellschaft (DE) 2020-12-09 EP disclosed
CN-112040951-A Antibody Drug Conjugates (ADC) with NAMPT inhibitors 拜耳股份公司 2020-12-04 CN disclosed
US-20200360531-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2020-11-19 US disclosed
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
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 ROCK2 1686/4885NAMPT 1/4885

“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.