SCHEMBL1028290

SCHEMBL1028290

Cc1cn(CC(C)C)c(C(=O)N2CCN(c3ccccc3)CC2)c1-c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
LMNA P02545 3/20 0.48
KMT2A Q03164 5/20 0.47
RAB9A P51151 1/20 0.47
MAPT P10636 4/20 0.46
GFER P55789 1/20 0.46
ATM Q13315 1/20 0.46
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
SHMT2 P34897 1/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
SLC6A7 Q99884 1/20 0.44
APOBEC3A P31941 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
TSHR P16473 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL1030219 0.92 ALDH1A1 (0.54) ALDH1A1LMNAKMT2AMAPTUSP2
SCHEMBL1031412 0.85 TACR3 (0.51) RAB9AMAPTHTR1AHTR7TP53
SCHEMBL1029785 0.83 LMNA (0.51) ALDH1A1LMNAKMT2AMAPTSMN1; SMN2
SCHEMBL1028177 0.81 CNR2 (0.48) ALDH1A1LMNAKMT2ARAB9AMAPT
SCHEMBL1029143 0.80 GFER (0.47) ALDH1A1KMT2AMAPTGFERUSP2
SCHEMBL1032537 0.79 CNR2 (0.53) ALDH1A1KMT2ARAB9ASMN1; SMN2MEN1
SCHEMBL1029907 0.78 PANK3 (0.41) KMT2AMAPTGFERATMPOLB
SCHEMBL15511503 0.77 ALDH1A1 (0.51) ALDH1A1KMT2ARAB9ASMN1; SMN2MEN1
SCHEMBL1032228 0.76 KMT2A (0.45) ALDH1A1LMNAKMT2AMAPTMEN1
SCHEMBL1030745 0.76 HSD11B1 (0.49) ALDH1A1LMNAKMT2AGFERATM

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 9 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
EP-2035375-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2009-03-18 EP claimed
WO-2007141039-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2007-12-13 WO 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
EP-2035375-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2009-03-18 EP disclosed
WO-2007141039-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2007-12-13 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-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments OPRL1, TPH1, OPRK1 ALDH1A1 2168/4885LMNA 2854/4885KMT2A 1507/4885

“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.