SCHEMBL983098

SCHEMBL983098

Oc1ccccc1CC(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.52
SLC6A2 P23975 3/20 0.51
SLC6A4 P31645 3/20 0.51
SLC6A3 Q01959 3/20 0.51
AKR1B1 P15121 1/20 0.50
CYP2D6 P10635 3/20 0.46
TSHR P16473 1/20 0.46
HIF1A Q16665 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
CYP3A4 P08684 2/20 0.45
IDO1 P14902 2/20 0.43
CA12 O43570 2/20 0.43
CA2 P00918 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
PKM P14618 1/20 0.42
KCNA5 P22460 1/20 0.42
CA9 Q16790 1/20 0.42
MPO P05164 1/20 0.42
KEAP1 Q14145 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
SCHEMBL30234428 1.00 HSPA5 (0.52) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
Formaldehyde SCHEMBL28679501 0.94 AKR1B1 (0.50) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL29120613 0.88 HPGD (0.48) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL25215353 0.81 SLC6A2 (0.47) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL11504679 0.81 SLC6A2 (0.47) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL1952363 0.81 SLC6A2 (0.47) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL11360188 0.81 SLC6A2 (0.47) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL231791 0.80 HSPA5 (0.50) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL29611994 0.80 HSPA5 (0.50) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1
SCHEMBL11360184 0.79 SLC6A2 (0.46) HSPA5SLC6A2SLC6A4SLC6A3AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118496435-B Functional polymer, preparation method and application thereof, tin powder modification method and tin paste 化学与精细化工广东省实验室 2024-10-01 CN claimed
CN-115885984-A Pyraclostrobin and epoxiconazole microemulsion as well as preparation method and application thereof 上海悦联生物科技有限公司 2023-04-04 CN claimed
US-4322312-A Process for purification of non-ionic emulsifiers BAYER AKTIENGESELLSCHAFT (DE) 1982-03-30 US claimed
CN-112394622-B Low-etching-rate developer composition and preparation method thereof 芯越微电子材料(嘉兴)有限公司 2025-05-09 CN disclosed
CN-115885984-A Pyraclostrobin and epoxiconazole microemulsion as well as preparation method and application thereof 上海悦联生物科技有限公司 2023-04-04 CN disclosed
EP-2275405-B1 PROCESS FOR PRODUCING ISOCYANATE USING DIARYL CARBONATE ASAHI CHEMICAL IND (JP) 2019-04-24 EP disclosed
EP-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
EP-2792673-B1 Carbamic acid ester derivatives for the production of isocyanate and aromatic hydroxy compounds ASAHI CHEMICAL IND (JP) 2018-07-25 EP disclosed
US-9637445-B2 Isocyanate production process using composition containing carbamic acid ester and aromatic hydroxy compound, and composition for transfer and storage of carbamic acid ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-05-02 US disclosed
EP-2147909-B1 METHOD FOR PRODUCTION OF ISOCYANATE USING COMPOSITION COMPRISING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSPORT OR STORAGE OF CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2016-12-14 EP disclosed
US-9233918-B2 Isocyanate production process ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-01-12 US disclosed
US-20100274047-A1 PROCESS FOR PRODUCING OF ISOCYANATES AND AROMATIC HYDROXY COMPOUNDS ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-10-28 US disclosed
EP-2213658-A1 METHOD FOR PRODUCTION OF ISOCYANATE AND AROMATIC HYDROXY COMPOUND Asahi Kasei Chemicals Corporation (JP) 2010-08-04 EP disclosed
US-20100113823-A1 ISOCYANATE PRODUCTION PROCESS USING COMPOSITION CONTAINING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSFER AND STORAGE OF CARBAMIC ACID ESTER ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-05-06 US disclosed
EP-2147909-A1 METHOD FOR PRODUCTION OF ISOCYANATE USING COMPOSITION COMPRISING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSPORT OR STORAGE OF CARBAMIC ACID ESTER Asahi Kasei Chemicals Corporation (JP) 2010-01-27 EP disclosed
US-5932641-A BLEND WITH THERMOSETTING, THERMOPLASTIC POLYMERS COATEX S.A. (FR) 1999-08-03 US disclosed
US-4322312-A Process for purification of non-ionic emulsifiers BAYER AKTIENGESELLSCHAFT (DE) 1982-03-30 US disclosed
US-4299959-A N-SUBSTITUTED IMINOCOUMARINS CIBA-GEIGY CORPORATION (US) 1981-11-10 US disclosed
EP-0012875-A1 Non-ionic emulsifying agents and process for their purification BAYER AG (DE) 1980-07-09 EP disclosed
US-4153618-A N-SUBSTITUTED IMINOCOUMARINS CIBA-GEIGY CORPORATION (US) 1979-05-08 US 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 (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-20100113823-A1 ISOCYANATE PRODUCTION PROCESS USING COMPOSITION CONTAINING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSFER AND STORAGE OF CARBAMIC ACID ESTER PAH, APEH, CPS1 HSPA5 4115/4885SLC6A2 2231/4885SLC6A4 3421/4885
US-20100274047-A1 PROCESS FOR PRODUCING OF ISOCYANATES AND AROMATIC HYDROXY COMPOUNDS PAH, APEH, HPD HSPA5 3143/4885SLC6A2 4038/4885SLC6A4 4114/4885

“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.