SCHEMBL1127485

SCHEMBL1127485

O=C(O)C(=O)c1ccc[nH]1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.53
▸ CYP2D6 P10635 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NAPRT Q6XQN6 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ATM Q13315 1/20 0.42

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
SCHEMBL5320628 0.87 TSHR (0.54) TSHRCYP2D6CYP1A2RAB9ASMN1; SMN2
SCHEMBL10141202 0.80 — —
SCHEMBL10141203 0.80 — —
SCHEMBL28298 0.80 — —
SCHEMBL21114388 0.80 TSHR (0.57) TSHRCYP2D6GAACYP1A2RAB9A
SCHEMBL27410499 0.79 TSHR (0.47) TSHRCYP1A2RAB9ASMN1; SMN2KDM4E
SCHEMBL1127202 0.79 TSHR (0.47) TSHRCYP2D6CYP1A2RAB9ASMN1; SMN2
SCHEMBL29137674 0.79 TSHR (0.47) TSHRCYP2D6CYP1A2RAB9ASMN1; SMN2
SCHEMBL1126578 0.79 TSHR (0.47) TSHRCYP2D6GAACYP1A2RAB9A
Hydrochloric Acid SCHEMBL1147719 0.78 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119490456-A Sulfonyl oxapyrazole preparation method 山东智荟检测科技有限公司 2025-02-21 — — CN disclosed
CN-119255702-A Stable liquid herbicide formulations of high-load sulfonyloxalamides 安道麦阿甘有限公司 2025-01-03 — — CN disclosed
CN-116098159-B Sulfonyl-oxalyl-pyrazole-containing weeding composition and application thereof 山东海利尔化工有限公司 2024-08-06 — — CN disclosed
CN-118203011-A Weeding composition containing pyridylphenyl isoxazolines and application thereof 潍坊中农联合化工有限公司 2024-06-18 — — CN disclosed
CN-116098159-A Sulfonyl-oxalyl-pyrazole-containing weeding composition and application thereof 山东海利尔化工有限公司 2023-05-12 — — CN disclosed
CN-116026961-A Method for measuring residual quantity of sulfonylgrass pyrazole and metabolite thereof in animal-derived products 泉州海关综合技术服务中心 2023-04-28 — — CN disclosed
CN-111868026-B Capsid protein assembly inhibitor containing N-heterocyclic five-membered ring, pharmaceutical composition and application thereof 正大天晴药业集团股份有限公司 2022-11-25 — — CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
CN-113631172-A Compositions and methods for targeting mutant RAS 宾夕法尼亚大学理事会 2021-11-09 — — CN disclosed
US-5958943-A ANTIALLERGENS, RHEUMATIC DISEASES MERCKLE GMBH (DE) 1999-09-28 — — US disclosed
US-5942535-A a!-Annelated pyrrole derivatives and pharmaceutical use thereof MERCKLE GMBH (DE) 1999-08-24 — — US disclosed
US-4243672-A CARDIOVASCULAR DISORDERS; CARDIOTONIC AGENTS PFIZER INC. (US) 1981-01-06 — — US disclosed
US-4243672-A CARDIOVASCULAR DISORDERS; CARDIOTONIC AGENTS PFIZER INC. (US) 1981-01-06 — — US disclosed
US-4243672-A CARDIOVASCULAR DISORDERS; CARDIOTONIC AGENTS PFIZER INC. (US) 1981-01-06 — — US disclosed
EP-0010553-A1 Process of reducing a loweralkyl 1-loweralkyl-pyrrole-2-glyoxylate to a loweralkyl 1-loweralkyl-pyrrole-2-acetate McNeilab, Inc. (US) 1980-05-14 — — EP disclosed
EP-0009326-A2 Pyrrolyl keto and amino acids and derivatives thereof, processes for their preparation and pharmaceutical compositions containing them Pfizer Limited (GB) 1980-04-02 — — EP disclosed
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