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
SCHEMBL1126578 0.79 TSHR (0.47) TSHRCYP2D6GAACYP1A2RAB9A
SCHEMBL29137674 0.79 TSHR (0.47) TSHRCYP2D6CYP1A2RAB9ASMN1; SMN2
Water SCHEMBL5567597 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