SCHEMBL4476893

SCHEMBL4476893

COc1cccc(S(=O)(=O)NCc2cc(-c3ccc(Cl)cc3Cl)n(-c3ccc(Cl)cc3)c2C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.52
MAPT P10636 5/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
KDR P35968 1/20 0.46
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 1/20 0.44
CHRNA7 P36544 1/20 0.43
HPGD P15428 1/20 0.41
MALT1 Q9UDY8 1/20 0.41
PTGS2 P35354 1/20 0.40
MEP1B Q16820 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 1/20 0.39
AKT1 P31749 1/20 0.38

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
SCHEMBL4490618 0.91 OPRL1 (0.57) OPRL1MAPTMEN1KMT2AFLT1
SCHEMBL4490776 0.85 OPRL1 (0.51) OPRL1MAPTALDH1A1CHRNA7MALT1
SCHEMBL4492245 0.76 OPRL1 (0.46) OPRL1MAPTALDH1A1LMNACHRNA7
Hydrochloric Acid SCHEMBL4485649 0.72 OPRL1 (0.52) OPRL1MAPTMEN1KMT2AALDH1A1
SCHEMBL4491425 0.70 FLT1 (0.47) MAPTMEN1KMT2AGAASMN1; SMN2
Hydrochloric Acid SCHEMBL4564842 0.69 OPRL1 (0.61) OPRL1KMT2ACHRNA7
SCHEMBL2770695 0.68 OPRL1 (0.56) OPRL1MAPTMEN1KMT2AGAA
SCHEMBL29668784 0.67 TP53 (0.61) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL1946461 0.66 MAPT (0.54) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL2540191 0.66 CNR1 (0.50) MAPTMEN1KMT2AGAASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524971-B2 1,5-diarylpyrrole derivatives, preparation method thereof and application of same in therapeutics SANOFI - AVENTIS (FR) 2009-04-28 US claimed
US-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-01-17 US claimed
US-7524971-B2 1,5-diarylpyrrole derivatives, preparation method thereof and application of same in therapeutics SANOFI - AVENTIS (FR) 2009-04-28 US disclosed
US-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-01-17 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-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS QDPR, DPYD, CD38 OPRL1 1286/4885MAPT 3797/4885MEN1 359/4885

“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.