SCHEMBL1109793

SCHEMBL1109793

OCCc1ccc(CBr)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 4/20 0.59
▸ TDP1 Q9NUW8 2/20 0.55
▸ TSHR P16473 2/20 0.46
▸ CA1 P00915 2/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA4 P22748 1/20 0.46
▸ CA6 P23280 1/20 0.46
▸ CA5A P35218 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA14 Q9ULX7 1/20 0.46
▸ CA5B Q9Y2D0 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ BACE1 P56817 1/20 0.46
▸ TRPA1 O75762 1/20 0.46
▸ CYP4F2 P78329 4/20 0.43

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
SCHEMBL40656 0.85 CA2 (0.77) CA2TDP1TSHRCA1CA12
SCHEMBL7339165 0.84 CA2 (0.50) CA2TDP1TSHRALDH1A1KDM4E
SCHEMBL1244949 0.83 CA2 (0.59) CA2TDP1TSHRCA1CA12
SCHEMBL6057959 0.82 CA2 (0.72) CA2TDP1TSHRCA1CA12
SCHEMBL2220712 0.82 TRPA1 (0.56) CA2TDP1TSHRALDH1A1TRPA1
SCHEMBL14072861 0.80 CA2 (0.53) CA2TSHRALDH1A1KDM4ETRPA1
SCHEMBL131361 0.78 ALDH1A1 (0.67) TDP1TSHRALDH1A1TRPA1CYP4F2
SCHEMBL5638 0.78 CA2 (0.59) CA2TDP1TSHRCA1CA12
SCHEMBL31337516 0.78 TDP1 (0.42) CA2TDP1TSHRCA1CA12
SCHEMBL5497046 0.78 TSHR (0.46) CA2TSHRALDH1A1TRPA1CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106957280-B Ether-type aryl bridged piperazine derivatives and its salt, preparation method and the purposes in preparation treatment anti-tumor drug 洛阳师范学院 2019-02-15 — — CN claimed
CN-106957280-A Ether-type aryl bridged piperazine derivatives and its salt, preparation method and the purposes in treatment antineoplastic is prepared 洛阳师范学院 2017-07-18 — — CN claimed
US-12497386-B2 Estrogen receptor-modulating compounds RADIUS PHARMACEUTICALS, INC. (US) 2025-12-16 — — US disclosed
EP-4561993-A1 INHIBITORS OF PLASMA KALLIKREIN Rezolute, Inc. (US) 2025-06-04 — — EP disclosed
US-20240308986-A1 ESTROGEN RECEPTOR-MODULATING COMPOUNDS RADIUS PHARMACEUTICALS, INC. 2024-09-19 — — US disclosed
CN-118359610-A MENIN-MLL interaction inhibitors 生命医药有限责任公司 2024-07-19 — — CN disclosed
US-12018019-B2 Estrogen receptor-modulating compounds RADIUS PHARMACEUTICALS, INC. (US) 2024-06-25 — — US disclosed
US-12018019-B2 Estrogen receptor-modulating compounds RADIUS PHARMACEUTICALS, INC. (US) 2024-06-25 — — US disclosed
US-12018019-B2 Estrogen receptor-modulating compounds RADIUS PHARMACEUTICALS, INC. (US) 2024-06-25 — — US disclosed
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC (US) 2024-04-18 — — US disclosed
WO-2024025907-A1 INHIBITORS OF PLASMA KALLIKREIN REZOLUTE, INC. (US) 2024-02-01 — — WO disclosed
EP-0472449-B1 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA (FR) 1994-09-14 — — EP disclosed
EP-0496548-A1 Carbacyclin analogs PURDUE RESEARCH FOUNDATION (US) 1992-07-29 — — EP disclosed
EP-0487270-A2 HIV protease inhibitors having polyether substituents MERCK & CO. INC. (US) 1992-05-27 — — EP disclosed
EP-0472449-A2 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-02-26 — — EP disclosed
US-5021414-A Antiestrogen IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-04 — — US disclosed
US-4904661-A ANTIESTROGENS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-27 — — US disclosed
US-4732912-A ANTIESTROGENS, ANTITUMOR AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-03-22 — — US disclosed
EP-0124369-B1 PHENOL DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-06-24 — — EP disclosed
EP-0124369-A1 Phenol derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-07 — — 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 (4 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-20240308986-A1 ESTROGEN RECEPTOR-MODULATING COMPOUNDS ESR2, GPER1, ESR1 CA2 2407/4885TDP1 4428/4885TSHR 186/4885
US-12018019-B2 Estrogen receptor-modulating compounds ESR2, GPER1, ESR1 CA2 2407/4885TDP1 4428/4885TSHR 186/4885
US-12497386-B2 Estrogen receptor-modulating compounds ESR2, GPER1, ESR1 CA2 2407/4885TDP1 4428/4885TSHR 186/4885
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 CA2 4247/4885TDP1 3347/4885TSHR 4567/4885

“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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