SCHEMBL40282

SCHEMBL40282

O=C(O)c1cccc(I)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA6 P23280 1/20 0.58
CA9 Q16790 1/20 0.58
MTOR P42345 1/20 0.54
HSD17B10 Q99714 2/20 0.54
KMO O15229 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
DAO P14920 1/20 0.52
TSHR P16473 1/20 0.52
NAPRT Q6XQN6 1/20 0.52
TPMT P51580 1/20 0.52
UNG P13051 1/20 0.52
FOLH1 Q04609 1/20 0.50
AKR1C3 P42330 1/20 0.50
TP53 P04637 1/20 0.48
RXRA P19793 1/20 0.47

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
SCHEMBL29532021 1.00 CA12 (0.58) CA12CA1CA2CA6CA9
Methane SCHEMBL14879758 0.98 CA12 (0.56) CA12CA1CA2CA6CA9
Hydrochloric Acid SCHEMBL4455397 0.98 CA12 (0.56) CA12CA1CA2CA6CA9
Ethane SCHEMBL7579504 0.96 MTOR (0.55) CA12CA1CA2CA6CA9
Aziridine SCHEMBL3898809 0.90 CA12 (0.48) CA12CA1CA2CA6CA9
Acetaldehyde SCHEMBL9117054 0.90 UNG (0.53) CA12CA1CA2CA6CA9
Toluene SCHEMBL27999625 0.88 MTOR (0.50) CA12CA1CA2CA6CA9
SCHEMBL7358622 0.85 KDM4E (0.57) CA12CA1CA2CA6CA9
SCHEMBL3673834 0.83 ATM (0.58) MTORALDH1A1TDP1L3MBTL1
SCHEMBL18079795 0.83 CES2 (0.54) MTOR

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

Appears in 2421 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
US-12497636-B2 Recombinant Saccharomyces cerevisiae cells for cannabinoid production NATIONAL UNIVERSITY OF SINGAPORE (SG) 2025-12-16 US claimed
CN-120040329-A Ring-opening steroid derivative containing oxime ester, preparation method and application thereof 常州工业职业技术学院 2025-05-27 CN claimed
EP-4529477-A1 POROUS EXPANDING BIOCOMPATIBLE SCAFFOLDS Danmarks Tekniske Universitet (DK) 2025-04-02 EP claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO 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
CN-114907201-B Green synthesis method for synthesizing 2-menaquinone 嘉兴学院 2024-05-24 CN claimed
CN-117925194-A Preparation method and application of indirect liquid cooling energy storage system cooling liquid 济南鼎隆化工科技有限公司 2024-04-26 CN claimed
CN-114920736-B Quinoline ring-containing 1,2, 4-oxadiazole substituted benzamide compound and preparation method and application thereof 浙江工业大学 2024-01-30 CN claimed
CN-114656461-B Quinoline ring-containing 1,2, 4-oxadiazole substituted benzamide compound and synthetic method and application thereof 浙江工业大学 2024-01-30 CN claimed
WO-1997027331-A2 METHODS AND COMPOSITIONS FOR DETERMINING THE SEQUENCE OF NUCLEIC ACID MOLECULES RAPIGENE, INC. (US) 1997-07-31 WO claimed
US-5618981-A Process for producing aromatic sulfides PHILLIPS PETROLEUM COMPANY (US) 1997-04-08 US claimed
EP-0070198-B1 RADIATION-SENSITIVE COMPOSITION AND PATTERN-FORMATION METHOD USING THE SAME Hitachi, Ltd. (JP) 1985-06-19 EP claimed
EP-0070198-A1 Radiation-sensitive composition and pattern-formation method using the same Hitachi, Ltd. (JP) 1983-01-19 EP claimed
US-4328162-A Process for preparing 9,11-unsaturated steroidal compound from the corresponding saturated steroidal compound EASTMAN KODAK COMPANY (US) 1982-05-04 US claimed
US-4290963-A HEATING ONE OF THE PREGNANE SERIES SCHERING AKTIENGESELLSCHAFT (DE) 1981-09-22 US claimed
US-4260464-A Process for the preparation of 17α-(3-iodobenzoyloxy)-9α-chloro-4-pregnene-3,20-diones and their D-homo homologs SCHERING AKTIENGESELLSCHAFT (DE) 1981-04-07 US claimed
US-4252719-A REMOVAL OF A TERTIARY HYDROGEN FROM A 5-A-STEROID BY CHLORINATING THE STEROID BEING FIRST ESTERIFIED BY AN IODOARYL-CONTAINING ESTERIFICATION AGENT RESEARCH CORPORATION (US) 1981-02-24 US claimed
EP-0001737-B1 17-ALPHA-(3-IODOBENZOYLOXY)-9-ALPHA-CHLORO-4-PREGNENE-3.20-DIONES, THEIR D-HOMO ANALOGUES AND PROCESS FOR THEIR PREPARATION SCHERING AKTIENGESELLSCHAFT (DE) 1981-01-07 EP claimed
US-4061661-A Δ9(11) -5α-20-KETO STEROIDS AND PROCESS FOR THEIR PRODUCTION SCHERING AKTIENGESELLSCHAFT (DT) 1977-12-06 US claimed