SCHEMBL289539

SCHEMBL289539

Cc1cc(C)c(-n2ccnc2P(C2CCCCC2)C2CCCCC2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.33
TAS1R1 Q7RTX1 2/20 0.33
TAS1R2 Q8TE23 2/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TP53 P04637 2/20 0.31
PSMB5 P28074 1/20 0.31
DRD4 P21917 1/20 0.31
EPHX2 P34913 3/20 0.30
NR1I2 O75469 1/20 0.30
KDM4B O94953 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30
DOHH Q9BU89 1/20 0.30
KDR P35968 1/20 0.30

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
SCHEMBL4903081 0.73 CRHR1 (0.30) SMN1; SMN2
SCHEMBL15921403 0.72 L3MBTL1 (0.36) ALDH1A1HTTSMN1; SMN2NPSR1KDM4E
SCHEMBL15920991 0.72 L3MBTL1 (0.38) POLBL3MBTL1
Hydrochloric Acid SCHEMBL6444703 0.71 ALDH1A1 (0.33) TAS1R3TAS1R1TAS1R2ALDH1A1POLB
SCHEMBL24445746 0.70 KDM4E (0.31) KDM4E
SCHEMBL24445753 0.69
SCHEMBL13706025 0.68 CYP3A4 (0.43) ALDH1A1MAPTSMN1; SMN2KDRKDM4E
SCHEMBL301559 0.68 TAS1R3 (0.40) TAS1R3TAS1R1TAS1R2ALDH1A1NPSR1
SCHEMBL13589306 0.65 KDM4E (0.33) ALDH1A1SMN1; SMN2TP53DRD4KDR
SCHEMBL5423379 0.65 L3MBTL1 (0.37) ALDH1A1SMN1; SMN2TP53DRD4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427468-B2 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PLC (GB) 2025-06-04 EP claimed
US-11939333-B2 Solid forms of isoquinolinones, and process of making, composition comprising, and methods of using the same INFINITY PHARMACEUTICALS, INC. (US) 2024-03-26 US claimed
CN-117144368-A Preparation method of efficient low-phosphorus corrosion inhibitor 广东天祺环保科技有限公司 2023-12-01 CN claimed
EP-4267591-A2 ORGANOMETALLIC COMPOUNDS Umicore AG & Co. KG (DE) 2023-11-01 EP claimed
CN-116802187-A Organometallic compounds 优米科尔股份公司及两合公司 2023-09-22 CN claimed
WO-2022136049-A2 ORGANOMETALLIC COMPOUNDS UMICORE AG & CO. KG (DE) 2022-06-30 WO claimed
CN-107226779-B Process for selective palladium catalysis of substituted diolefins to telomers 国际香料和香精公司 2021-08-20 CN claimed
EP-3222610-B1 METHOD FOR SELECTIVE PALLADIUM-CATALYZED TELOMERIZATION OF SUBSTITUTED DIENES INT FLAVORS & FRAGRANCES INC (US) 2018-12-05 EP claimed
US-20170275235-A1 METHOD FOR SELECTIVE PALLADIUM-CATALYZED TELOMERIZATION OF SUBSTITUTED DIENES INT FLAVORS & FRAGRANCES INC (US) 2017-09-28 US claimed
EP-3222610-A1 METHOD FOR SELECTIVE PALLADIUM-CATALYZED TELOMERIZATION OF SUBSTITUTED DIENES International Flavors & Fragrances Inc. (US) 2017-09-27 EP claimed
EP-2975019-A1 RUTHENIUM CATALYZED HYDROAMINOMETHYLATION Evonik Degussa GmbH (DE) 2016-01-20 EP claimed
EP-2951143-A1 METHOD FOR THE CARBONYLATION OF OLEFINS Evonik Degussa GmbH (DE) 2015-12-09 EP claimed
EP-2951188-A1 PHOSPHORUS LIGANDS AND METHOD FOR THE SELECTIVE RUTHENIUM-CATALYZED HYDROAMINOMETHYLATION OF OLEFINS Evonik Degussa GmbH (DE) 2015-12-09 EP claimed
WO-2015063543-A1 HYDRIDOPALLADIUM(II) HALIDES AS PREFORMED CATALYSTS FOR SUZUKI-MIYAURA CROSS-COUPLING REACTIONS LATVIAN INSTITUTE OF ORGANIC SYNTHESIS (LV) 2015-05-07 WO claimed
WO-2014118046-A1 METHOD FOR THE CARBONYLATION OF OLEFINS EVONIK INDUSTRIES AG (DE) 2014-08-07 WO claimed
WO-2014118038-A1 PHOSPHORUS LIGANDS AND METHOD FOR THE SELECTIVE RUTHENIUM-CATALYZED HYDROAMINOMETHYLATION OF OLEFINS EVONIK INDUSTRIES AG (DE) 2014-08-07 WO claimed
US-8772520-B2 Preparation of a metal complex JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2014-07-08 US claimed
US-20120116109-A1 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2012-05-10 US claimed
EP-2427468-A1 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2012-03-14 EP claimed
WO-2010128316-A1 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2010-11-11 WO 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 (3 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-20170275235-A1 METHOD FOR SELECTIVE PALLADIUM-CATALYZED TELOMERIZATION OF SUBSTITUTED DIENES TELO2, MCM5, TAF5 TAS1R3 3418/4885TAS1R1 3898/4885TAS1R2 3340/4885
US-11939333-B2 Solid forms of isoquinolinones, and process of making, composition comprising, and methods of using the same PIK3CA, PIK3C2A, PIK3CD TAS1R3 3856/4885TAS1R1 3953/4885TAS1R2 4301/4885
US-20120116109-A1 PREPARATION OF A METAL COMPLEX PDCD1LG2, CD274, PDCD2L TAS1R3 2182/4885TAS1R1 2371/4885TAS1R2 1493/4885

“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.