SCHEMBL29940209

SCHEMBL29940209

COC(=O)c1cc(Cl)cc(Br)c1N

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.51
KDM4E B2RXH2 8/20 0.46
POLB P06746 1/20 0.46
GAA P10253 8/20 0.45
ALDH1A1 P00352 8/20 0.44
HPGD P15428 6/20 0.44
HSD17B10 Q99714 3/20 0.44
MAPT P10636 2/20 0.44
SERPINH1 P50454 1/20 0.43
GLA P06280 3/20 0.43
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
NQO2 P16083 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
CFTR P13569 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL19776258 1.00 ABL1 (0.51) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL140598 0.82 KDM4E (0.61) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL29562450 0.82 KDM4E (0.49) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL505256 0.82 ABL1 (0.64) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL1119372 0.82 KDM4E (0.49) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL25213358 0.81 KDM4E (0.51) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL1056378 0.81 ABL1 (0.53) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL3203329 0.81 ABL1 (0.45) ABL1KDM4EPOLBGAAMAPT
SCHEMBL1003428 0.81 ABL1 (0.53) ABL1KDM4EPOLBGAAALDH1A1
SCHEMBL31636871 0.81 ABL1 (0.45) ABL1GAAALDH1A1MAPTSERPINH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308229-A1 INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2024-01-24 EP disclosed
US-20230088326-A1 PROCESS FOR PREPARATION OF ARTHROPODICIDAL ANTHRANILAMIDE COMPOUNDS UPL LTD (IN) 2023-03-23 US disclosed
WO-2022197763-A1 INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 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-20230088326-A1 PROCESS FOR PREPARATION OF ARTHROPODICIDAL ANTHRANILAMIDE COMPOUNDS ANTXR2, APEH, TYR ABL1 68/4885KDM4E 1445/4885POLB 2371/4885

“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.