SCHEMBL12435675

SCHEMBL12435675

CC(C)(C)C(CO)CCCCN

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.35
CPB2 Q96IY4 5/20 0.35
RNPEP Q9H4A4 1/20 0.34
NFKB1 P19838 1/20 0.32
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA3 P07451 2/20 0.30
CA4 P22748 2/20 0.30
CA6 P23280 2/20 0.30
CA5A P35218 2/20 0.30
CA7 P43166 2/20 0.30
CA9 Q16790 2/20 0.30
CA14 Q9ULX7 2/20 0.30
CA5B Q9Y2D0 2/20 0.30
DNM1 Q05193 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
BLM P54132 1/20 0.30

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
SCHEMBL13108938 0.93 CPB2 (0.34) CPB2
SCHEMBL13108940 0.83 GABRR1 (0.32) TSHR
SCHEMBL728821 0.79 LMNA (0.50) CA2LMNATSHRBLM
SCHEMBL11890976 0.78 DPP4 (0.31) TSHR
SCHEMBL25221549 0.77 LMNA (0.54) CA2LMNATSHRBLM
SCHEMBL25350040 0.77 LMNA (0.54) CA2LMNATSHRBLM
SCHEMBL25215364 0.77 LMNA (0.54) CA2LMNATSHRBLM
SCHEMBL28463622 0.77 TSHR (0.36) TSHR
SCHEMBL16174341 0.73
SCHEMBL9242529 0.73 DNM1 (0.33) CPB2NFKB1DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9428448-B2 Compounds and methods of treating obesity YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2016-08-30 US disclosed
US-20140309273-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-10-16 US disclosed
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW (IL) 2011-07-21 US disclosed
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW (IL) 2011-07-21 US disclosed
US-7816489-B2 Methods for making intermediates and oxytocin analogues FERRING B.V. (NL) 2010-10-19 US disclosed
US-20080177035-A1 METHODS FOR MAKING INTERMEDIATES AND OXYTOCIN ANALOGUES FERRING B.V. (NL) 2008-07-24 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 (3 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-20140309273-A1 COMPOUNDS AND METHODS OF TREATING OBESITY FABP4, LIPC, GPR119 GSR 724/4885CPB2 1441/4885RNPEP 3120/4885
US-20080177035-A1 METHODS FOR MAKING INTERMEDIATES AND OXYTOCIN ANALOGUES OXTR, AVPR1A, AVPR1B GSR 2242/4885CPB2 1924/4885RNPEP 231/4885
US-20110178151-A1 COMPOUNDS AND METHODS OF TREATING OBESITY GPR119, FABP4, LIPC GSR 958/4885CPB2 1554/4885RNPEP 3404/4885

“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.