SCHEMBL15528784

SCHEMBL15528784

CC(=O)N1CC(c2ccc(NC(=O)N3CC(c4cccnc4)C3)cc2)C1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 7/20 0.61
CYP3A4 P08684 2/20 0.57
GRIN2B Q13224 5/20 0.57
LMNA P02545 2/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
TP53 P04637 3/20 0.47
MAPT P10636 2/20 0.46
STAT1 P42224 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL15528951 0.92 NAMPT (0.56) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15529115 0.92 NPC1 (0.57) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15529997 0.89 NAMPT (0.62) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15528743 0.88 NAMPT (0.57) NAMPTCYP3A4
SCHEMBL15528801 0.87 CYP3A4 (0.59) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15529251 0.87 NAMPT (0.61) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15529067 0.87 NAMPT (0.58) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15528993 0.87 NAMPT (0.60) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15529240 0.86 NAMPT (0.57) NAMPTCYP3A4GRIN2BLMNANPC1
SCHEMBL15528788 0.86 NAMPT (0.58) NAMPTCYP3A4GRIN2BLMNANPC1

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-2852585-A1 NAMPT INHIBITORS AbbVie Inc. (US) 2015-04-01 EP claimed
US-20140336168-A1 NAMPT INHIBITORS ABBVIE INC. 2014-11-13 US claimed
WO-2013170113-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 WO claimed
US-9758511-B2 NAMPT inhibitors ABBVIE INC. (US) 2017-09-12 US disclosed
US-20160168134-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-16 US disclosed
US-9296723-B2 NAMPT inhibitors ABBVIE INC. (US) 2016-03-29 US disclosed
EP-2852585-A1 NAMPT INHIBITORS AbbVie Inc. (US) 2015-04-01 EP disclosed
US-20140336168-A1 NAMPT INHIBITORS ABBVIE INC. 2014-11-13 US disclosed
WO-2013170113-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 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 (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-20160168134-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT NAMPT 1/4885CYP3A4 4662/4885GRIN2B 1070/4885
US-20140336168-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT NAMPT 1/4885CYP3A4 4662/4885GRIN2B 1070/4885

“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.