SCHEMBL1032220

SCHEMBL1032220

Cc1cn(C)c(C(=O)Nc2ccccc2)c1-c1ccco1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.47
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
HPGD P15428 5/20 0.46
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
MAPT P10636 3/20 0.46
HSD17B10 Q99714 3/20 0.46
PTPN7 P35236 2/20 0.46
MAPK1 P28482 2/20 0.46
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
ALOX15 P16050 1/20 0.46
CASP1 P29466 1/20 0.46
HTT P42858 1/20 0.46
BLM P54132 1/20 0.46
CASP7 P55210 1/20 0.46
MCL1 Q07820 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
UBA2 Q9UBT2 1/20 0.46

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
SCHEMBL1031516 0.90 LMNA (0.54) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1030274 0.83 POLB (0.46) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1032207 0.80 ADORA3 (0.40) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1027475 0.78 NPC1 (0.44) RAB9AMEN1KMT2AKDM4EHSD17B10
SCHEMBL1031744 0.77 NPC1 (0.49) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1031918 0.76 ALDH1A1 (0.47) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1031580 0.75 ALDH1A1 (0.55) RAB9AMEN1KMT2AHPGDALDH1A1
SCHEMBL1027476 0.74 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10HTTLMNA
SCHEMBL1032230 0.73 ADORA3 (0.55) RAB9AHPGDALDH1A1KDM4EUSP2
SCHEMBL1031541 0.72 RAB9A (0.53) RAB9AMEN1KMT2AHPGDALDH1A1

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
US-7968591-B2 1,3-disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their use in medicaments GRUENENTHAL GMBH (DE) 2011-06-28 US claimed
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
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 RAB9A 4091/4885MEN1 4776/4885KMT2A 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.