SCHEMBL4181632

SCHEMBL4181632

O=C(CCC1CCCC1)NCC1CN(S(=O)(=O)c2ccc(Cl)cc2Cl)CCO1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ACLY P53396 1/20 0.43
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
ACKR3 P25106 1/20 0.42
TP53 P04637 1/20 0.41
EPHX2 P34913 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL4186171 0.90 KMT2A (0.44) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL4194619 0.90 KMT2A (0.44) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL4185927 0.88 KMT2A (0.43) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL4188110 0.88 POLB (0.45) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL4194908 0.88 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL4185265 0.88 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL4178272 0.87 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL4185687 0.87 KMT2A (0.42) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL4175732 0.86 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL4175731 0.86 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNAL3MBTL1

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 4 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

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 3090/4885ALDH1A1 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.