SCHEMBL15529329

SCHEMBL15529329

CC1(C(=O)N2CC(c3ccc(NC(=O)N4CC(c5cccnc5)C4)cc3)C2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.57
CYP3A4 P08684 2/20 0.54
GRIN2B Q13224 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
CYP2D6 P10635 1/20 0.43
HPGD P15428 1/20 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
SCHEMBL15529747 0.96 NAMPT (0.56) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15529299 0.93 NAMPT (0.65) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15529489 0.93 NAMPT (0.59) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15529738 0.89 NAMPT (0.60) NAMPTCYP3A4
SCHEMBL15529612 0.89 NAMPT (0.60) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15529840 0.89 NAMPT (0.55) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15528784 0.86 NAMPT (0.61) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15528859 0.85 NAMPT (0.56) NAMPTCYP3A4
SCHEMBL15529997 0.85 NAMPT (0.62) NAMPTCYP3A4GRIN2BSMN1; SMN2LMNA
SCHEMBL15528965 0.84 NAMPT (0.71) NAMPT

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.