SCHEMBL2679862

SCHEMBL2679862

COc1ccc(NC(=O)Nc2ccc(C)c(NC(=O)/C=C\c3cccnc3)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 15/20 0.60
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.56
ATM Q13315 1/20 0.56
KDM4E B2RXH2 1/20 0.56
MMP1 P03956 2/20 0.53
MMP2 P08253 2/20 0.53
MMP9 P14780 2/20 0.53
EGFR P00533 1/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP1B1 Q16678 1/20 0.53

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
SCHEMBL2679864 1.00 NAMPT (0.60) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL10054906 1.00 NAMPT (0.60) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL10054903 0.89 NAMPT (0.65) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL2679253 0.89 NAMPT (0.65) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL2679256 0.89 NAMPT (0.65) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL2679746 0.89 NAMPT (0.58) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL10054908 0.88 NAMPT (0.63) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL2679198 0.88 NAMPT (0.63) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL2679200 0.88 NAMPT (0.63) NAMPTMEN1LMNAMAPTKMT2A
SCHEMBL10054905 0.83 MEN1 (0.59) NAMPTMEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 US claimed
US-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament BEIJING JIASHILIANBO PHARM SCI & TECH CO. LTD 2012-05-10 US claimed
US-8426446-B2 Acrylamide derivative and use thereof in manufacture of medicament BEIJING SHIQIAO BIOPHARM CO. LTD. (CN) 2013-04-23 US disclosed
US-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament BEIJING JIASHILIANBO PHARM SCI & TECH CO. LTD 2012-05-10 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-20120116075-A1 Acrylamide Derivative And Use Thereof In Manufacture Of Medicament ABL1, ABL2, BCR NAMPT 3700/4885MEN1 3934/4885LMNA 4558/4885

“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.