SCHEMBL2007683

SCHEMBL2007683

Cc1ccc(C)c(P(c2ccccc2)c2ccccc2)c1-c1c(C)ccc(C)c1P(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ESR1 P03372 4/20 0.38
ESR2 Q92731 4/20 0.38
CYP1A2 P05177 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 2/20 0.33
ACHE P22303 2/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
DRD1 P21728 2/20 0.31
MYC P01106 1/20 0.31

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
SCHEMBL12601255 0.82 CYP3A4 (0.39) CYP3A4TDP1ESR1ESR2TSHR
SCHEMBL1011883 0.81 TDP1 (0.52) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL1768175 0.77 CYP3A4 (0.42) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL21333867 0.77 MYC (0.47) CYP3A4TDP1ESR1ESR2TSHR
SCHEMBL20873230 0.74 TDP1 (0.44) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL7999830 0.73 TDP1 (0.48) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL23182095 0.72 CYP3A4 (0.42) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL20697881 0.72 TRPA1 (0.45) CYP3A4TDP1ESR1ESR2CYP1A2
SCHEMBL19251642 0.72 CYP3A4 (0.42) CYP3A4TDP1ESR1ESR2CYP1A2
O-Xylene SCHEMBL5617302 0.72 CYP3A4 (0.71) CYP3A4TDP1ESR1ESR2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650207-B1 Process for producing optically active 3-quinuclidinols TAKASAGO PERFUMERY CO LTD (JP) 2007-06-27 EP claimed
WO-2025096445-A1 SYNTHESIS OF INTERMEDIATES FOR THE PREPARATION OF MACROCYCLIC COMPOUNDS ALKERMES, INC. (US) 2025-05-08 WO disclosed
US-10029968-B2 Process for producing alcohol analogue TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-07-24 US disclosed
US-20170297990-A1 PROCESS FOR PRODUCING ALCOHOL ANALOGUE TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-10-19 US disclosed
EP-2611819-B1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND TAKASAGO PERFUMERY CO LTD (JP) 2015-12-16 EP disclosed
US-9012649-B2 Method for producing optically active 2-arylpiperidinium salt TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-04-21 US disclosed
US-20140213792-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 2-ARYLPIPERIDINIUM SALT TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-07-31 US disclosed
EP-1698609-B1 Process for producing an alcohol or its silyl ether TAKASAGO PERFUMERY CO LTD (JP) 2013-07-31 EP disclosed
US-20130116438-A1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-05-09 US disclosed
US-8076503-B2 Process for production of optically active aminophosphinylbutanoic acids MEIJI SEIKA PHARMA CO., LTD. (JP) 2011-12-13 US disclosed
EP-1650207-B1 Process for producing optically active 3-quinuclidinols TAKASAGO PERFUMERY CO LTD (JP) 2007-06-27 EP disclosed
EP-1698609-A1 Process for producing an alcohol or its silyl ether Takasago International Corporation (JP) 2006-09-06 EP disclosed
EP-1650207-A1 Process for producing optically active 3-quinuclidinols Takasago International Corporation (JP) 2006-04-26 EP disclosed
US-20060047122-A1 Process for producing optically active-3-quinuclidinols TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-03-02 US disclosed
EP-0831099-B1 Process for preparing ruthenium-phosphine complex TAKASAGO PERFUMERY CO LTD (JP) 2002-07-17 EP disclosed
US-5919962-A CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-07-06 US disclosed
EP-0831099-A2 Process for preparing ruthenium-phosphine complex Takasago International Corporation (JP) 1998-03-25 EP disclosed
US-4861890-A Isomerization HOFFMANN-LA ROCHE INC. (US) 1989-08-29 US disclosed
US-4556740-A Phosphorus compounds HOFFMANN-LA ROCHE INC. (US) 1985-12-03 US disclosed
EP-0104375-A1 Phosphorus-containing biphenyl derivatives and their use in asymmetric hydrogenation and enatioselective hydrogen shifts F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-04-04 EP 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 (5 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-20130116438-A1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND PPIP5K2, INF2, IMPDH2 CYP3A4 790/4885TDP1 3026/4885ESR1 3282/4885
US-20060047122-A1 Process for producing optically active-3-quinuclidinols DHPS, QDPR, TYR CYP3A4 1583/4885TDP1 3546/4885ESR1 4803/4885
US-20170297990-A1 PROCESS FOR PRODUCING ALCOHOL ANALOGUE ADH1A, ADH1C, ADH5 CYP3A4 523/4885TDP1 4077/4885ESR1 1875/4885
US-20140213792-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 2-ARYLPIPERIDINIUM SALT REN, KCNH3, KCNH2 CYP3A4 1499/4885TDP1 3727/4885ESR1 4788/4885
US-10029968-B2 Process for producing alcohol analogue ADH1A, ADH1C, ADH5 CYP3A4 523/4885TDP1 4077/4885ESR1 1875/4885

“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.