SCHEMBL4183423

SCHEMBL4183423

CCCC[C@H](NC(=O)c1ccccc1)C(=O)NCC1CN(S(=O)(=O)c2ccc(Cl)cc2)CCO1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
CCR1 P32246 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.42
CXCR3 P49682 1/20 0.41
CA2 P00918 1/20 0.41
USP5 P45974 1/20 0.40

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
SCHEMBL4191798 0.95 CCR1 (0.51) KMT2AMEN1CCR1SMN1; SMN2ALDH1A1
SCHEMBL4183297 0.89 CCR1 (0.50) KMT2AMEN1CCR1SMN1; SMN2ALDH1A1
SCHEMBL4178178 0.89 ACLY (0.43) KMT2AMEN1CCR1ALDH1A1POLB
SCHEMBL4181213 0.86 CTSL (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1MAPK1
SCHEMBL4175710 0.86 CTSK (0.44) KMT2AMEN1CCR1MAPK1
SCHEMBL4183283 0.84 CCR1 (0.46) KMT2AMEN1CCR1ALDH1A1POLB
SCHEMBL4188373 0.83 CTSS (0.39) MAPK1KDM4E
SCHEMBL4185754 0.81 CTSK (0.46)
SCHEMBL4187937 0.80 CNR1 (0.43) KMT2AMEN1
SCHEMBL4183425 0.79 MAPK1 (0.43) KMT2AMEN1ALDH1A1MAPK1KDM4E

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 KMT2A 3870/4885MEN1 3090/4885CCR1 283/4885

“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.