SCHEMBL1028097

SCHEMBL1028097

Cc1cn(Cc2ccccc2)c(C(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 2/20 0.52
ALDH1A1 P00352 7/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 2/20 0.50
HSD11B1 P28845 1/20 0.48
GPR183 P32249 3/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
TSHR P16473 1/20 0.46
HRH3 Q9Y5N1 2/20 0.45
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL1030745 0.86 HSD11B1 (0.49) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL1031060 0.85 CYP2C9 (0.43) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL1748810 0.81 SCN5A (0.46) MEN1KMT2AHPGD
SCHEMBL1027171 0.80 SMN1; SMN2 (0.45) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL27750827 0.79 ALDH1A1 (0.44) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL15511503 0.79 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1MEN1KMT2AGAA
SCHEMBL1028177 0.79 CNR2 (0.48) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL1032537 0.79 CNR2 (0.53) SMN1; SMN2ALDH1A1MEN1KMT2AGAA
SCHEMBL2638817 0.79 NOTUM (0.48) SMN1; SMN2LMNAALDH1A1KDM4EHPGD
SCHEMBL1028656 0.77 SMN1; SMN2 (0.43) SMN1; SMN2LMNAALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 EP claimed
US-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments GRUENENTHAL GMBH (DE) 2009-05-28 US claimed
US-7968591-B2 1,3-disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their use in medicaments GRUENENTHAL GMBH (DE) 2011-06-28 US disclosed
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 EP disclosed
US-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments GRUENENTHAL GMBH (DE) 2009-05-28 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-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments OPRL1, TPH1, OPRK1 SMN1; SMN2 2916/4885LMNA 2854/4885ALDH1A1 2168/4885

“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.