SCHEMBL231282

SCHEMBL231282

O=C(O)COCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
PAM P19021 1/20 0.53
ALDH1A1 P00352 3/20 0.52
GRM5 P41594 2/20 0.51
NPC1 O15118 2/20 0.50
KMT2A Q03164 2/20 0.50
RAB9A P51151 1/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
AKR1B1 P15121 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPT P10636 1/20 0.49
KEAP1 Q14145 1/20 0.46

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
SCHEMBL4226282 0.98 TSHR (0.58) TSHRPAMALDH1A1GRM5NPC1
Hydrochloric Acid SCHEMBL7053203 0.98 TSHR (0.58) TSHRPAMALDH1A1GRM5NPC1
Acetic Acid SCHEMBL28567289 0.92 ALDH1A1 (0.55) TSHRPAMALDH1A1GRM5NPC1
Ether SCHEMBL954914 0.90 ALDH1A1 (0.50) TSHRPAMALDH1A1GRM5NPC1
SCHEMBL8775706 0.90 TSHR (0.54) TSHRPAMALDH1A1GRM5NPC1
SCHEMBL1956559 0.90 TSHR (0.54) TSHRPAMALDH1A1GRM5KMT2A
Trifluoroacetic Acid SCHEMBL4658961 0.89 CES1 (0.52) TSHRPAMALDH1A1GRM5
SCHEMBL4966266 0.88 NAAA (0.53) TSHRPAMALDH1A1GRM5KMT2A
SCHEMBL4963940 0.88 NAAA (0.53) TSHRPAMALDH1A1GRM5KMT2A
SCHEMBL3543002 0.88 NAAA (0.53) TSHRPAMALDH1A1GRM5KMT2A

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 1439 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025235686-A1 FLUOROCAMPTOTHECIN COMPOUNDS, CONJUGATES, AND METHODS THEREOF Aarvik Therapeutics, Inc. (US) 2025-11-13 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-117304464-A Benzyloxy modified polymer and application thereof as oxygen scavenging material 杭州碳氧力科技有限公司 2023-12-29 CN claimed
WO-2023180786-A1 PLANT OIL-BASED POLYMER FOAM AND METHOD OF MANUFACTURE THEREOF LATVIJAS VALSTS KOKSNES ĶĪMIJAS INSTITŪTS (LV) 2023-09-28 WO claimed
EP-4249546-A1 PLANT OIL-BASED POLYMER FOAM AND METHOD OF MANUFACTURE THEREOF LATVIJAS VALSTS KOKSNES KIMIJAS INSTITUTS (LV) 2023-09-27 EP claimed
CN-110862400-A Preparation process of camptothecin-hydroxyacetic acid intermediate 遵义医学院 2020-03-06 CN claimed
CN-110862403-A Camptothecin-glycolic acid-norcantharidin conjugate and application thereof 遵义医学院 2020-03-06 CN claimed
US-10544119-B2 Preparation method for chiral intermediate for use in statins ASYMCHEM LABORATORIES (TIANJIN) CO., LTD. (CN) 2020-01-28 US claimed
EP-3141544-B1 PREPARATION METHOD FOR CHIRAL INTERMEDIATE FOR USE IN STATINS ASYMCHEM LABORATORIES (TIANJIN) CO LTD (CN) 2018-02-07 EP claimed
US-20170190684-A1 PREPARATION METHOD FOR CHIRAL INTERMEDIATE FOR USE IN STATINS ASYMCHEM LABORATORIES (TIANJIN) CO., LTD. (CN) 2017-07-06 US claimed
WO-2006002810-A1 PHENYL SUBSTITUTED [1.2]-OXAZINE-3,5-DIONE AND DIHYDROPYRONE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2006-01-12 WO claimed
WO-2006000355-A1 3'-ALKOXY SPIROCYCLIC TETRAMIC AND TETRONIC ACIDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2006-01-05 WO claimed
EP-1587367-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC DICARBONYL COMPOUNDS AND SAFENERS Bayer CropScience AG (DE) 2005-10-26 EP claimed
WO-2005092897-A2 2,4,6-PHENYLSUBSTITUTED CYCLIC KETOENOLES BAYER CROPSCIENCE AG (DE) 2005-10-06 WO claimed
WO-2005044796-A1 2-HALOGEN-6-ALKYL-PHENYL SUBSTITUTED SPIROCYCLIC TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-05-19 WO claimed
WO-2005016873-A2 4-BIPHENYLSUBSTITUTED PYRAZOLIDIN-3,5-DIONE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-02-24 WO claimed
WO-2004111042-A1 N-HETEROCYCLYL PHENYL-SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-12-23 WO claimed
WO-2004064520-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC DICARBONYL COMPOUNDS AND SAFENERS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-05 WO claimed
US-6391916-B1 ANTITUMOR AGENTS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2002-05-21 US claimed
EP-0425650-B1 ANTI-INFLAMMATORY 4-AMINOPHENOL DERIVATIVES FISONS PLC (GB) 1995-08-09 EP claimed

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-20170190684-A1 PREPARATION METHOD FOR CHIRAL INTERMEDIATE FOR USE IN STATINS HMGCR, COASY, CETP TSHR 4445/4885PAM 2482/4885ALDH1A1 571/4885
US-10544119-B2 Preparation method for chiral intermediate for use in statins HMGCR, COASY, CETP TSHR 4445/4885PAM 2482/4885ALDH1A1 571/4885

“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.