SCHEMBL20875117

SCHEMBL20875117

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ccc2ccn(C(=O)O)c2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ OXER1 Q8TDS5 2/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ TFPI2 P48307 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ NPY2R P49146 1/20 0.32
▸ GSK3B P49841 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ FABP4 P15090 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MT-CO2 P00403 1/20 0.30

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
SCHEMBL19476349 0.90 PIK3CA (0.37) KDM4EALDH1A1TP53HPGDHSD17B10
SCHEMBL10117911 0.79 PIK3CD (0.43) HTR6NOTUML3MBTL1
SCHEMBL28301646 0.76 ENPP3 (0.34) MCL1
SCHEMBL15202439 0.76 GSK3B (0.34) HTR6GSK3B
SCHEMBL20914435 0.73 AGXT (0.35) KDM4EALDH1A1HPGDHSD17B10MCL1
SCHEMBL12903453 0.72 BRD4 (0.46) KDM4EHTR6GSK3BMCL1PAX8
SCHEMBL19476354 0.72 NR1H2 (0.37) —
SCHEMBL19463917 0.71 MAOA (0.46) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL14006351 0.71 MCL1 (0.41) KDM4EALDH1A1TP53HPGDHSD17B10
SCHEMBL30071051 0.70 NR1H2 (0.36) —

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
US-20230339954-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-10-26 — — US disclosed
CN-115650985-A Heterocyclic compounds as RET kinase inhibitors 癌症研究科技有限公司 2023-01-31 — — CN disclosed
US-11548896-B2 Heterocyclic compounds as RET kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-01-10 — — US disclosed
CN-109195972-B Heterocyclic compounds as RET kinase inhibitors 癌症研究科技有限公司 2022-10-28 — — CN disclosed
EP-3960180-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS Cancer Research Technology Limited (GB) 2022-03-02 — — EP disclosed
EP-3442980-B1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECH LTD (GB) 2021-06-09 — — EP disclosed
US-20210155628-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECH LTD (GB) 2021-05-27 — — US disclosed
US-10954241-B2 Heterocyclic compounds as ret kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-03-23 — — US disclosed
US-20190106425-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-04-11 — — 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 (5 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-20210155628-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, REL, BCR KDM4E 977/4885ALDH1A1 3019/4885TP53 703/4885
US-20190106425-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS RET, REL, BCR KDM4E 977/4885ALDH1A1 3019/4885TP53 703/4885
US-11548896-B2 Heterocyclic compounds as RET kinase inhibitors RET, REL, BCR KDM4E 977/4885ALDH1A1 3019/4885TP53 703/4885
US-20230339954-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, REL, BCR KDM4E 977/4885ALDH1A1 3019/4885TP53 703/4885
US-10954241-B2 Heterocyclic compounds as ret kinase inhibitors RET, REL, BCR KDM4E 977/4885ALDH1A1 3019/4885TP53 703/4885

“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.

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