SCHEMBL22070145

SCHEMBL22070145

COC(=O)C(C)c1c(C)n(C)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ HPGD P15428 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ PABPC1 P11940 1/20 0.45
▸ EIF4H Q15056 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ EGFR P00533 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ NR4A2 P43354 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL10467315 0.85 ALDH1A1 (0.43) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL28621894 0.82 POLB (0.48) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL29123401 0.77 POLB (0.44) KDM4EHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL27680089 0.77 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL17616023 0.77 GPR3 (0.52) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL2184283 0.77 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL28836465 0.76 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL10467337 0.75 TRPM8 (0.47) ALDH1A1CYP2C19KMT2AMEN1SMN1; SMN2
SCHEMBL10776104 0.75 TRPM8 (0.47) ALDH1A1CYP2C19KMT2AMEN1SMN1; SMN2
SCHEMBL28836488 0.75 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018093-B2 Hemiasterlin derivatives and antibody-drug conjugates including same Sumitomo Pharma Co., Ltd. (JP) 2024-06-25 — — US disclosed
EP-4321523-A2 HEMIASTERLIN DERIVATIVES AND ANTIBODY-DRUG CONJUGATES INCLUDING SAME Sumitomo Pharma Co., Ltd. (JP) 2024-02-14 — — EP disclosed
US-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-06-30 — — US disclosed
CN-113412271-A Hamiltrin derivatives having cysteine residue 大日本住友制药株式会社 2021-09-17 — — CN disclosed
US-20200247845-A1 Hemiasterlin Derivatives and Antibody-Drug Conjugates Including Same SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-06 — — US disclosed
EP-3666788-A1 HEMIASTERLIN DERIVATIVES AND ANTIBODY-DRUG CONJUGATES INCLUDING SAME Sumitomo Dainippon Pharma Co., Ltd. (JP) 2020-06-17 — — EP disclosed
CN-111051329-A Hamiltrin derivatives and antibody drug complexes thereof 大日本住友制药株式会社 2020-04-21 — — CN disclosed
CN-111032676-A Antibody drug complex comprising a hemiasterlin derivative 大日本住友制药株式会社 2020-04-17 — — CN disclosed
CN-104125956-A Cyclic amides as inhibitors of 11-beta-hydroxysteroid dehydrogenase and uses thereof CONNEXIOS LIFE SCIENCES PVT LTD 2014-10-29 — — CN disclosed
CN-104125960-A Derivatives of aza adamantane and uses thereof CONNEXIOS LIFE SCIENCES PVT LTD 2014-10-29 — — CN 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-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells POU5F1, POU2F1, POU2F2 KDM4E 785/4885ALDH1A1 24/4885HPGD 4801/4885
US-20200247845-A1 Hemiasterlin Derivatives and Antibody-Drug Conjugates Including Same FCGRT, QARS1, INHA KDM4E 574/4885ALDH1A1 1215/4885HPGD 2797/4885
US-12018093-B2 Hemiasterlin derivatives and antibody-drug conjugates including same FCGRT, QARS1, INHA KDM4E 574/4885ALDH1A1 1215/4885HPGD 2797/4885

“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.

Send feedback