SCHEMBL15529504

SCHEMBL15529504

O=C(Nc1ccc(C2CCN(C(=O)C3CC3)CC2)cc1)N1CC(c2cccnn2)C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 17/20 0.54
NPC1 O15118 3/20 0.49
TP53 P04637 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL15529654 0.97 NAMPT (0.53) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529963 0.89 NPC1 (0.51) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529486 0.86 NAMPT (0.54) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15528730 0.86 NAMPT (0.64) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529550 0.85 NAMPT (0.48) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529190 0.85 NAMPT (0.64) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529416 0.84 NAMPT (0.60) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529465 0.84 NAMPT (0.65) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL16228309 0.84 NAMPT (0.52) NAMPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL15529176 0.84 NAMPT (0.56) NAMPTNPC1TP53RAB9ASMN1; SMN2

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 1/4885NPC1 88/4885TP53 4150/4885
US-20140336168-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT NAMPT 1/4885NPC1 88/4885TP53 4150/4885

“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.