SCHEMBL15533237

SCHEMBL15533237

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

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.48
ALOX15 P16050 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TRPV1 Q8NER1 4/20 0.46
RIPK1 Q13546 1/20 0.41
MCHR1 Q99705 2/20 0.41
RXFP1 Q9HBX9 2/20 0.40
MAPT P10636 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 2/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 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
SCHEMBL15536153 0.94 USP2 (0.53) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380459 0.89 USP2 (0.47) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379873 0.89 USP2 (0.47) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380035 0.88 USP2 (0.49) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379802 0.87 NAMPT (0.47) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379165 0.87 PTPN2 (0.56) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379162 0.87 PTPN2 (0.56) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15378949 0.86 USP2 (0.48) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15380134 0.86 SMN1; SMN2 (0.44) USP2ALOX15SMN1; SMN2HSD17B10TRPV1
SCHEMBL15379501 0.86 USP2 (0.49) 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 3 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 disclosed
WO-2013170115-A1 PYRIDAZINE AND PYRIDINE DERIVATIVES AS NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 WO disclosed
US-20080188423-A1 PI-3 KINASE INHIBITOR PRODRUGS SIGNALRX PHARMACEUTICALS, INC. 2008-08-07 US 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 (1 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-20080188423-A1 PI-3 KINASE INHIBITOR PRODRUGS PI4KA, PI4KB, PI4K2B USP2 2018/4885ALOX15 4389/4885SMN1; SMN2 4629/4885

“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.