SCHEMBL497789

SCHEMBL497789

COC(=O)c1ccc(C=O)cc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.59
HPGD P15428 3/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
HSP90AA1 P07900 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GLA P06280 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44

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
SCHEMBL3509685 0.86 ALDH1A1 (0.55) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL16956580 0.86 KDM4E (0.46) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL5033639 0.85 ALDH1A1 (0.58) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL11469172 0.85 ALDH1A1 (0.58) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL29907874 0.84 ALDH1A1 (0.68) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL24861874 0.84 KDM4E (0.45) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL10165329 0.84 KDM4E (0.45) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL28763812 0.83 PTGS2 (0.49) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL28763808 0.83 PTGS2 (0.49) ALDH1A1HPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL18432645 0.83 PTGS2 (0.49) ALDH1A1HPGDMAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059949-A Preparation and application of isoxazoline derivative containing triazole thioether structure 贵州大学 2026-05-19 CN disclosed
US-12606533-B2 3-phenylpropylamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2026-04-21 US disclosed
US-20260070879-A1 ISOXAZOLINE DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2026-03-12 US disclosed
US-12564193-B2 Isoxazoline-substituted benzamide derivative, and preparation method therefor and use thereof SHANDONG UNITED PESTICIDE INDUSTRY CO., LTD. (CN) 2026-03-03 US disclosed
US-20250380697-A1 ISOXAZOLINE DERIVATIVE COMPOUND AND INSECTICIDAL COMPOSITION COMPRISING SAME KYUNG NONG CORPORATION (KR) 2025-12-18 US disclosed
US-12497370-B2 Isoxazoline derivatives ELANCO TIERGESUNDHEIT AG (CH) 2025-12-16 US disclosed
US-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-11-20 US disclosed
WO-2025228900-A1 ARYLAMIDE SUBSTITUTED INDAZOLES AND THE USE THEREOF AS MEDICAMENT BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-11-06 WO disclosed
EP-4159732-B1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF SHANDONG UNITED PESTICIDE IND CO LTD (CN) 2025-10-15 EP disclosed
CN-120004816-A Isoxazoline derivatives 礼蓝动物保健有限公司 2025-05-16 CN disclosed
US-4753962-A HYPOGLYCEMIC, ANTIOBESITY AGENT BEECHAM GROUP P.L.C. (GB) 1988-06-28 US disclosed
US-4708441-A LIQUID CRYSTALS HOFFMAN-LA ROCHE INC. (US) 1987-11-24 US disclosed
US-4704005-A LIQUID CRYSTALS HOFFMANN-LA ROCHE INC. (US) 1987-11-03 US disclosed
US-4654371-A ANTI-OBESITY, HYPOGLYCEMIA AGENTS BEECHAM GROUP P.L.C. (GB) 1987-03-31 US disclosed
US-4613208-A ELECTROOPTICS; ULTRAVIOLET RADIATION STABILITY; QUICK RESPONSE HOFFMANN-LA ROCHE INC. (US) 1986-09-23 US disclosed
US-4595521-A In liquid crystalline carrier HOFFMANN-LA ROCHE INC. (US) 1986-06-17 US disclosed
US-4550981-A Liquid crystalline esters and mixtures HOFFMANN-LA ROCHE INC. (US) 1985-11-05 US disclosed
US-4478849-A HYPERGLYCEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1984-10-23 US disclosed
EP-0006735-B1 SECONDARY AMINES, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE BEECHAM GROUP PLC (GB) 1983-06-15 EP disclosed
EP-0006735-A1 Secondary amines, their preparation, pharmaceutical compositions containing them and their use BEECHAM GROUP PLC (GB) 1980-01-09 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 (6 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-12564193-B2 Isoxazoline-substituted benzamide derivative, and preparation method therefor and use thereof CYP4F11, CYP4Z1, CYP4X1 ALDH1A1 1874/4885HPGD 3387/4885MAPT 1682/4885
US-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE SF1, SF3A1, SFXN1 ALDH1A1 358/4885HPGD 2153/4885MAPT 2719/4885
US-12497370-B2 Isoxazoline derivatives CYP3A7, CYP4X1, CYP2A7 ALDH1A1 906/4885HPGD 1527/4885MAPT 3165/4885
US-20260070879-A1 ISOXAZOLINE DERIVATIVES CHRM1, CBR3, AFF1 ALDH1A1 972/4885HPGD 3759/4885MAPT 4877/4885
US-20250380697-A1 ISOXAZOLINE DERIVATIVE COMPOUND AND INSECTICIDAL COMPOSITION COMPRISING SAME VIP, CASP7, CYP4X1 ALDH1A1 1181/4885HPGD 1764/4885MAPT 2451/4885
US-12606533-B2 3-phenylpropylamine derivative SF3A1, SF1, HTR1D ALDH1A1 357/4885HPGD 3743/4885MAPT 4210/4885

“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.