SCHEMBL4919152

SCHEMBL4919152

COC(=O)c1cc(Cl)cnc1CBr

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 4/20 0.44
ABL1 P00519 1/20 0.41
NR4A2 P43354 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SERPINH1 P50454 1/20 0.38
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
GAA P10253 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL29227006 0.87 OPRK1 (0.44) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL4160132 0.87 OPRK1 (0.44) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL18132246 0.84 CYP4F2 (0.51) OPRK1ALDH1A1CYP4F2CYP4A11KDM4E
SCHEMBL20184058 0.82 OPRK1 (0.48) OPRK1
SCHEMBL19682934 0.80 KDR (0.49) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL30816026 0.80 OPRK1 (0.48) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL473981 0.80 OPRK1 (0.48) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL18132203 0.80 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EGAASMN1; SMN2
SCHEMBL401530 0.78 OPRK1 (0.47) OPRK1ABL1NR4A2ALDH1A1SLC6A4
SCHEMBL4443153 0.78 HSP90AA1 (0.47) ALDH1A1SLC6A4SLC6A3HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025262433-A1 N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2025-12-26 WO disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
EP-1824841-A1 SUBSTITUTED PYRROLE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-08-29 EP disclosed
WO-2006064944-A1 SUBSTITUTED PYRROLE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 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-20080176906-A1 Substituted Pyrrole Derivative AR, NR5A1, MC2R OPRK1 217/4885ABL1 1146/4885NR4A2 233/4885

“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.