SCHEMBL5510059

SCHEMBL5510059

O=C(O)CCC(=O)c1ccc(Cl)c(S(=O)(=O)NCC2CCCCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.52
▸ BCL2L1 Q07817 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CNR2 P34972 2/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ GSTO1 P78417 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
SCHEMBL5503771 1.00 KMT2A (0.52) KMT2ABCL2L1MCL1ALDH1A1SMN1; SMN2
SCHEMBL5508316 0.89 CNR2 (0.43) KMT2AALDH1A1POLBTDP1L3MBTL1
SCHEMBL11409462 0.88 KMT2A (0.46) KMT2ABCL2L1MCL1ALDH1A1SMN1; SMN2
SCHEMBL11528664 0.86 KMT2A (0.51) KMT2ABCL2L1MCL1ALDH1A1SMN1; SMN2
SCHEMBL11349061 0.84 ALDH1A1 (0.50) KMT2AALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL5508077 0.84 ALDH1A1 (0.50) KMT2AALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL5504001 0.84 ALDH1A1 (0.50) KMT2AALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL11346990 0.84 ALDH1A1 (0.50) KMT2AALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL5508282 0.83 ALDH1A1 (0.51) KMT2AALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL11346245 0.80 CA1 (0.45) ALDH1A1SMN1; SMN2POLBL3MBTL1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265278-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS AVENTIS PHARMACEUTICALS INC. (US) 2007-11-15 — — US disclosed
EP-1844011-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS Aventis Pharmaceuticals Inc. (US) 2007-10-17 — — EP disclosed
WO-2006081343-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS AVENTIS PHARMACEUTICALS INC. (US) 2006-08-03 — — 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-20070265278-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS PTGDR2, PTGDR, CYSLTR2 KMT2A 4133/4885BCL2L1 2190/4885MCL1 2714/4885

“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.

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