SCHEMBL67590

SCHEMBL67590

COc1ccc2c(c1)SCCC2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 1.00
HTT P42858 1/20 1.00
ALDH1A1 P00352 3/20 0.61
RYR2 Q92736 4/20 0.50
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
VHL P40337 1/20 0.46
ELOC Q15369 1/20 0.46
ELOB Q15370 1/20 0.46
METAP1 P53582 1/20 0.45
LMNA P02545 1/20 0.44
KCNH2 Q12809 1/20 0.42
MIF P14174 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
CA12 O43570 1/20 0.40
PDE3B Q13370 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
SCHEMBL6366190 0.90 KDM4E (0.82) KDM4EHTTALDH1A1RYR2MAOA
SCHEMBL11283 0.87 KDM4E (0.77) KDM4EHTTALDH1A1RYR2MAOA
SCHEMBL29596397 0.87 KDM4E (0.77) KDM4EHTTALDH1A1RYR2MAOA
SCHEMBL68574 0.83 KDM4E (0.71) KDM4EHTTALDH1A1RYR2MAOA
SCHEMBL22714471 0.81 KDM4E (0.68) KDM4EHTTALDH1A1MAOAMAOB
SCHEMBL11477365 0.80 KDM4E (0.67) KDM4EHTTALDH1A1MAOAMAOB
SCHEMBL29756838 0.78 KDM4E (0.63) KDM4EHTTALDH1A1VHLELOC
SCHEMBL20165128 0.78 KDM4E (0.63) KDM4EHTTALDH1A1VHLELOC
SCHEMBL7222447 0.78 KDM4E (0.63) KDM4EHTTALDH1A1RYR2MAOA
SCHEMBL2775772 0.77 KDM4E (0.63) KDM4EHTTALDH1A1MAOAMAOB

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 144 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115836077-B Oxazaspiro derivative, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2025-05-13 CN disclosed
US-20250129076-A1 FUSED TETRACYCLIC COMPOUNDS, COMPOSITIONS AND DIAGNOSTIC APPLICATIONS THEREOF BENAZIR FATHIMA (IN) 2025-04-24 US disclosed
US-12037501-B2 Photocurable ink composition and image recording method FUJIFILM CORPORATION (JP) 2024-07-16 US disclosed
US-11850287-B2 Heterocyclic acyl hydrazone linkers, methods and uses thereof ONTARIO INSTITUTE FOR CANCER SEARCH (OICR) (CA) 2023-12-26 US disclosed
US-20230234962-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-07-27 US disclosed
US-20230234962-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-07-27 US disclosed
US-20230234962-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-07-27 US disclosed
CN-113754685-B Dihydrothiochromene pyrazole derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2023-06-16 CN disclosed
EP-4190789-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2023-06-07 EP disclosed
EP-4190789-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2023-06-07 EP disclosed
US-5547975-A ANTIARTHRIC AGENTS, ANALGESICS AND ANTIPYRETICS; INHIBITORS OF CYCLOOXYGENASE II; SIDE EFFECT REDUCTION G.D. SEARLE & CO. 1996-08-20 US disclosed
WO-1996009304-A1 BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-28 WO disclosed
EP-0396620-B1 AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS ABBOTT LABORATORIES (US) 1993-08-11 EP disclosed
US-5185364-A Selectively inhibit alpha-2-adrenergic receptors ABBOTT LABORATORIES (US) 1993-02-09 US disclosed
US-5140039-A Antidepressants, metabolic disorders ABBOTT LABORATORIES (US) 1992-08-18 US disclosed
US-5089519-A Antidepressants; antagonists for alpha-2-adrenergic receptors ABBOTT LABORATORIES (US) 1992-02-18 US disclosed
EP-0396620-A4 AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS 1991-01-23 EP disclosed
EP-0396620-A1 AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS. ABBOTT LAB (US) 1990-11-14 EP disclosed
EP-0325964-A1 Aminomethyl-chroman and -thiochroman compounds ABBOTT LABORATORIES (US) 1989-08-02 EP disclosed
WO-1989006534-A1 AMINOMETHYL-CHROMAN AND -THIOCHROMAN COMPOUNDS ABBOTT LABORATORIES (US) 1989-07-27 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 (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-20230234962-A1 OXA-AZASPIRO DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF PIK3CD, PIK3CA, PIK3R5 KDM4E 3238/4885HTT 4290/4885ALDH1A1 704/4885
US-20250129076-A1 FUSED TETRACYCLIC COMPOUNDS, COMPOSITIONS AND DIAGNOSTIC APPLICATIONS THEREOF POLRMT, POLM, DNTT KDM4E 4802/4885HTT 644/4885ALDH1A1 1893/4885
US-11850287-B2 Heterocyclic acyl hydrazone linkers, methods and uses thereof HDAC6, C9, AADAC KDM4E 1071/4885HTT 1365/4885ALDH1A1 178/4885

“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.