SCHEMBL29697271

SCHEMBL29697271

CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)c1ccc(F)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.44
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
CTSL P07711 1/20 0.39
CTSS P25774 4/20 0.39
CTSK P43235 4/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
AAK1 Q2M2I8 2/20 0.38
SCN9A Q15858 1/20 0.38
PTPN1 P18031 1/20 0.36
AURKB Q96GD4 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
SCHEMBL22990779 1.00 EGFR (0.44) EGFRALDH1A1MAPTKDM4EGAA
SCHEMBL22981289 0.83 ALDH1A1 (0.43) ALDH1A1KDM4E
SCHEMBL29177690 0.81 EGFR (0.39) EGFRALDH1A1GAAAAK1AURKB
SCHEMBL22990703 0.78 HSD17B1 (0.42) CTSLCTSSCTSKSCN9A
SCHEMBL18180261 0.78 CTSS (0.46) ALDH1A1MAPTKDM4EGAAPKM
SCHEMBL18317296 0.78 CTSS (0.46) ALDH1A1MAPTKDM4EGAAPKM
SCHEMBL18180266 0.77 CTSS (0.44) ALDH1A1MAPTKDM4EGAAPKM
SCHEMBL30475323 0.77 ALDH1A1 (0.45) ALDH1A1
SCHEMBL28673700 0.77 ALDH1A1 (0.45) ALDH1A1
SCHEMBL18180269 0.76 CTSS (0.47) CTSLCTSSCTSKSCN9APTPN1

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-12358886-B2 Heterocyclic compounds for use in the treatment of cancer ARTIOS PHARMA LIMITED (GB) 2025-07-15 US disclosed
EP-4010080-B1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LTD (GB) 2023-09-27 EP disclosed
US-20230242503-A9 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LIMITED (GB) 2023-08-03 US disclosed
US-20220298134-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LIMITED (GB) 2022-09-22 US disclosed
EP-4010080-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER Artios Pharma Limited (GB) 2022-06-15 EP 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 (3 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-20230242503-A9 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER SDHA, SDHB, NQO1 EGFR 458/4885ALDH1A1 97/4885MAPT 4052/4885
US-20220298134-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER SDHA, SDHB, NQO1 EGFR 458/4885ALDH1A1 97/4885MAPT 4052/4885
US-12358886-B2 Heterocyclic compounds for use in the treatment of cancer SDHA, DPYD, TP53 EGFR 575/4885ALDH1A1 232/4885MAPT 4249/4885

“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.