SCHEMBL2991518

SCHEMBL2991518

NC(=O)Nc1cc(S(=O)(=O)N2CCCCc3ccccc32)ccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.65
KMT2A Q03164 7/20 0.64
MEN1 O00255 3/20 0.64
MAPT P10636 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TP53 P04637 2/20 0.55
AKR1C3 P42330 1/20 0.54
NPC1 O15118 1/20 0.53
TSHR P16473 1/20 0.53
ALDH1A1 P00352 1/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL5478565 0.88 KMT2A (0.71) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL2987927 0.87 LMNA (0.60) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL2992522 0.85 LMNA (0.58) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL5471844 0.84 LMNA (0.71) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL5467360 0.83 LMNA (0.70) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL5461080 0.83 LMNA (0.64) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL14597064 0.82 KMT2A (0.61) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL2996113 0.82 KMT2A (0.65) LMNAKMT2AMEN1TP53AKR1C3
SCHEMBL5474219 0.82 LMNA (0.76) LMNAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL5472807 0.82 LMNA (0.76) LMNAKMT2AMEN1MAPTSMN1; SMN2

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.