SCHEMBL15529007

SCHEMBL15529007

O=C(Nc1ccc(C2CN(C(=O)c3ccoc3)C2)cc1)N1CC(c2cccnc2)C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 13/20 0.54
CYP3A4 P08684 2/20 0.50
GRIN2B Q13224 1/20 0.49
CCR5 P51681 1/20 0.44
SCD O00767 1/20 0.42
SCD5 Q86SK9 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41

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
SCHEMBL15529649 0.93 NAMPT (0.50) NAMPTCYP3A4GRIN2BCCR5
SCHEMBL15528995 0.93 NAMPT (0.50) NAMPTCYP3A4GRIN2B
SCHEMBL16228939 0.90 NAMPT (0.51) NAMPTCYP3A4
SCHEMBL15529003 0.86 NAMPT (0.61) NAMPTCYP3A4GRIN2BSCDSCD5
SCHEMBL15529506 0.85 NAMPT (0.57) NAMPT
SCHEMBL15529523 0.83 NAMPT (0.58) NAMPTCYP3A4GRIN2B
SCHEMBL16228841 0.82 NAMPT (0.57) NAMPTCYP3A4GRIN2BSCDSCD5
SCHEMBL15529997 0.82 NAMPT (0.62) NAMPTCYP3A4GRIN2B
SCHEMBL15528784 0.81 NAMPT (0.61) NAMPTCYP3A4GRIN2B
SCHEMBL15529482 0.80 NAMPT (0.60) NAMPTCYP3A4GRIN2B

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 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.