SCHEMBL36091

SCHEMBL36091

COc1ccc(C(=O)O)cc1Br

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.76
CYP1A2 P05177 1/20 0.70
CYP2D6 P10635 1/20 0.70
HPGD P15428 1/20 0.70
CYP2C19 P33261 1/20 0.70
CA12 O43570 1/20 0.69
CA1 P00915 1/20 0.69
CA2 P00918 1/20 0.69
CA4 P22748 1/20 0.69
CA6 P23280 1/20 0.69
CA7 P43166 1/20 0.69
TPMT P51580 1/20 0.69
CA9 Q16790 1/20 0.69
CA14 Q9ULX7 1/20 0.69
HTT P42858 3/20 0.62
LMNA P02545 3/20 0.62
RAB9A P51151 2/20 0.62
MAPK1 P28482 2/20 0.62
PKM P14618 3/20 0.60
TSHR P16473 2/20 0.59

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
SCHEMBL31652866 1.00 ALDH1A1 (0.76) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
Benzoic Acid SCHEMBL11509726 0.93 CYP1A2 (0.77) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL27630437 0.86 ALDH1A1 (1.00) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL7502240 0.86 ALDH1A1 (0.62) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL313116 0.85 ALDH1A1 (0.76) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL644265 0.85 CA12 (0.69) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL29810107 0.83 ALDH1A1 (0.73) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL36283 0.83 ALDH1A1 (0.73) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL8156286 0.83 ALDH1A1 (0.73) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19
SCHEMBL1287590 0.83 ALDH1A1 (0.73) ALDH1A1CYP1A2CYP2D6HPGDCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250214921-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND KAO CORPORATION (JP) 2025-07-03 US claimed
EP-4501896-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND Kao Corporation (JP) 2025-02-05 EP claimed
CN-118973990-A Process for producing cyclic diketone compound 花王株式会社 2024-11-15 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
WO-2023189722-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND 花王株式会社 2023-10-05 WO claimed
CN-103102263-A 3-bromine-4-methoxybenzoic acid preparation method and agricultural biological activity UNIV QINGDAO AGRICULTURAL 2013-05-15 CN claimed
EP-4743457-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 FOR THERAPEUTIC USE 4M THERAPEUTICS INC. (US) 2026-05-20 EP disclosed
CN-122059950-A Compounds with proteasome agonistic activity, preparation method and application thereof 浙大城市学院 2026-05-19 CN disclosed
EP-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
US-20250214920-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND KAO CORPORATION (JP) 2025-07-03 US disclosed
US-20250214921-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND KAO CORPORATION (JP) 2025-07-03 US disclosed
CN-120192323-A Pyrrolidone-containing compounds 正大天晴药业集团股份有限公司 2025-06-24 CN disclosed
EP-4501897-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND Kao Corporation (JP) 2025-02-05 EP disclosed
EP-0124476-B1 CARBOXAMIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1988-06-22 EP disclosed
EP-0244088-A2 1-Phenyl-3-benzazepine compounds and medicaments containing these compounds for treating gastrointestinal motility disorders SMITHKLINE BEECHAM CORPORATION (US) 1987-11-04 EP disclosed
US-4559349-A TREATMENT OF PHYCHOSIS CIBA GEIGY CORPORATION (US) 1985-12-17 US disclosed
US-4508911-A Amine intermediates for analgesic compounds THE UPJOHN COMPANY (US) 1985-04-02 US disclosed
EP-0124476-A1 Carboxamides, process for their preparation and pharmaceutical preparations containing them CIBA-GEIGY AG (CH) 1984-11-07 EP disclosed
US-4438130-A Analgesic 1-oxa-, aza- and thia-spirocyclic compounds THE UPJOHN COMPANY (US) 1984-03-20 US disclosed
US-4346101-A NON-SEDATING THE UPJOHN COMPANY (US) 1982-08-24 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 (2 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-20250214920-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND CYP4F2, DUOX1, BCKDK ALDH1A1 973/4885CYP1A2 114/4885CYP2D6 189/4885
US-20250214921-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND HSD17B7, HSD17B12, BCKDK ALDH1A1 699/4885CYP1A2 201/4885CYP2D6 244/4885

“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.