SCHEMBL2992522

SCHEMBL2992522

CC(=N)CC(=O)Nc1cc(S(=O)(=O)N2CCCCc3ccccc32)ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.58
KMT2A Q03164 5/20 0.56
MEN1 O00255 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 5/20 0.50
ALDH1A1 P00352 2/20 0.50
TSHR P16473 2/20 0.49
TP53 P04637 2/20 0.49
MAPK1 P28482 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 1/20 0.49

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
SCHEMBL2987927 0.93 LMNA (0.60) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL2991518 0.85 LMNA (0.65) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5478565 0.82 KMT2A (0.71) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL14597064 0.80 KMT2A (0.61) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5471844 0.77 LMNA (0.71) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5467360 0.76 LMNA (0.70) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5478567 0.76 LMNA (0.64) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5461080 0.75 LMNA (0.64) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5467482 0.75 LMNA (0.66) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5468998 0.75 LMNA (0.68) LMNAKMT2AMEN1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507536-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2013-08-13 US disclosed
US-20130040975-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2013-02-14 US disclosed
US-8263588-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2012-09-11 US disclosed
US-20100184741-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2010-07-22 US disclosed
WO-2008124614-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2008-10-16 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-20130040975-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR LMNA 2763/4885KMT2A 1562/4885MEN1 592/4885
US-20100184741-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR LMNA 2763/4885KMT2A 1562/4885MEN1 592/4885

“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.