SCHEMBL4179250

SCHEMBL4179250

CC(C)C[C@H](NC(=O)Cc1cccnc1)C(=O)NCC1CN(S(=O)(=O)c2ccc(Cl)cc2Cl)CCO1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 3/20 0.39
USP2 O75604 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 2/20 0.39
GLA P06280 1/20 0.39
ACLY P53396 1/20 0.38
RECQL P46063 3/20 0.38
MAPT P10636 1/20 0.38
NAMPT P43490 2/20 0.37
MEN1 O00255 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4178078 0.84 CTSL (0.41) LMNASMN1; SMN2ALDH1A1KMT2AACLY
SCHEMBL4180784 0.83 CCR1 (0.46) ALDH1A1KMT2AACLYMEN1
SCHEMBL4185698 0.82 KMT2A (0.40) LMNASMN1; SMN2ALDH1A1KMT2AACLY
SCHEMBL4185265 0.81 KMT2A (0.42) LMNAALDH1A1KMT2AACLYMEN1
SCHEMBL4194908 0.81 KMT2A (0.42) LMNAALDH1A1KMT2AACLYMEN1
SCHEMBL4183315 0.80 KMT2A (0.45) ALDH1A1KMT2AACLYMEN1
SCHEMBL4178713 0.79 TRPV4 (0.60) ACLY
SCHEMBL4185931 0.79 TRPV4 (0.60) ACLY
SCHEMBL4185675 0.79 TRPV4 (0.60) ACLY
SCHEMBL5493100 0.77 TRPV4 (0.58) ACLY

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-20090124619-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-05-14 US claimed
EP-1869026-A1 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2007-12-26 EP claimed
WO-2006105475-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-05 WO claimed
US-20090124619-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-05-14 US disclosed
EP-1869026-A1 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2007-12-26 EP disclosed
WO-2006105475-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-05 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 (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-20090124619-A1 NOVEL COMPOUNDS TRPV4, TRPC4, TRPV1 LMNA 1737/4885SMN1; SMN2 3714/4885ALDH1A1 961/4885

“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.