SCHEMBL15380459

SCHEMBL15380459

CC(C)(C)C(=O)N1CCC(c2ccc(NC(=O)[C@H]3CCN(c4cccnn4)C3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TRPV1 Q8NER1 3/20 0.46
NAMPT P43490 6/20 0.44
RIPK1 Q13546 1/20 0.40
MCHR1 Q99705 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL15379873 1.00 USP2 (0.47) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15378972 0.94 USP2 (0.51) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380650 0.94 TRPV1 (0.48) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15378949 0.94 USP2 (0.48) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380134 0.91 SMN1; SMN2 (0.44) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380035 0.90 USP2 (0.49) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15533237 0.89 USP2 (0.48) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379165 0.89 PTPN2 (0.56) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379162 0.89 PTPN2 (0.56) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379802 0.89 NAMPT (0.47) USP2ALOX15SMN1; SMN2HSD17B10TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2847181-A1 PYRIDAZINE AND PYRIDINE DERIVATIVES AS NAMPT INHIBITORS AbbVie Inc. (US) 2015-03-18 EP claimed
US-8975398-B2 NAMPT inhibitors ABBVIE INC. (US) 2015-03-10 US claimed
WO-2013170115-A1 PYRIDAZINE AND PYRIDINE DERIVATIVES AS NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 WO claimed
US-20130303509-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US claimed
US-20130303510-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US claimed
US-20170065575-A1 NAMPT INHIBITORS ABBVIE INC (US) 2017-03-09 US disclosed
US-20150141398-A1 NAMPT INHIBITORS ABBVIE INC. 2015-05-21 US disclosed
EP-2847181-A1 PYRIDAZINE AND PYRIDINE DERIVATIVES AS NAMPT INHIBITORS AbbVie Inc. (US) 2015-03-18 EP disclosed
US-8975398-B2 NAMPT inhibitors ABBVIE INC. (US) 2015-03-10 US disclosed
US-20130303510-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
US-20130303509-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
WO-2013170115-A1 PYRIDAZINE AND PYRIDINE DERIVATIVES AS 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 (4 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-20150141398-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP2 4168/4885ALOX15 1919/4885SMN1; SMN2 334/4885
US-20170065575-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP2 4168/4885ALOX15 1919/4885SMN1; SMN2 334/4885
US-20130303510-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP2 4168/4885ALOX15 1919/4885SMN1; SMN2 334/4885
US-20130303509-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP2 4168/4885ALOX15 1919/4885SMN1; SMN2 334/4885

“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.