SCHEMBL15380320

SCHEMBL15380320

CC(C)(C)OC(=O)N1CCC(c2ccc(C(=O)N[C@H]3CCN(c4cccnn4)C3)s2)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.46
GPR119 Q8TDV5 2/20 0.45
GLS O94925 12/20 0.43
SLC6A2 P23975 1/20 0.43
TACR1 P25103 1/20 0.43
OPRM1 P35372 1/20 0.43
HTR2B P41595 1/20 0.43
SLC6A3 Q01959 1/20 0.43
POLB P06746 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
SCHEMBL15380319 1.00 USP30 (0.46) USP30GPR119GLSSLC6A2TACR1
SCHEMBL15379933 0.95 GPR119 (0.44) USP30GPR119POLB
SCHEMBL15378359 0.89 GLS (0.44) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15530893 0.89 GLS (0.44) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15379867 0.86 GLS (0.44) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15379700 0.86 GLS (0.44) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15379588 0.85 GLS (0.43) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15530508 0.85 GLS (0.43) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15531078 0.85 GLS (0.48) GLSSLC6A2TACR1OPRM1HTR2B
SCHEMBL15379291 0.85 GLS (0.48) GLSSLC6A2TACR1OPRM1HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20130303509-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 US disclosed
US-20130303510-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 USP30 4391/4885GPR119 662/4885GLS 26/4885
US-20170065575-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP30 4391/4885GPR119 662/4885GLS 26/4885
US-20130303510-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP30 4391/4885GPR119 662/4885GLS 26/4885
US-20130303509-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT USP30 4391/4885GPR119 662/4885GLS 26/4885

“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.