SCHEMBL15528801

SCHEMBL15528801

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

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.59
NAMPT P43490 10/20 0.58
GRIN2B Q13224 3/20 0.54
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL15529208 0.93 NAMPT (0.69) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL15528763 0.93 NAMPT (0.63) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL15529249 0.91 CYP3A4 (0.58) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL15528998 0.89 NAMPT (0.57) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL15528943 0.89 NAMPT (0.58) CYP3A4NAMPT
SCHEMBL15528784 0.87 NAMPT (0.61) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL15529493 0.87 NAMPT (0.59) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL16219016 0.87 CYP11B2 (0.49) CYP3A4NAMPTLMNA
SCHEMBL15529997 0.86 NAMPT (0.62) CYP3A4NAMPTGRIN2BLMNASMN1; SMN2
SCHEMBL16228537 0.86 NAMPT (0.58) CYP3A4NAMPTGRIN2BSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296723-B2 NAMPT inhibitors ABBVIE INC. (US) 2016-03-29 US claimed
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 CYP3A4 4662/4885NAMPT 1/4885GRIN2B 1070/4885
US-20140336168-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT CYP3A4 4662/4885NAMPT 1/4885GRIN2B 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.