SCHEMBL1043409

SCHEMBL1043409

COc1ccc(P(c2ccc(OC)cc2)c2ccc3c(c2-c2c(P(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc4c2OCO4)OCO3)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
PKM P14618 1/20 0.39
CYP19A1 P11511 1/20 0.37
NQO2 P16083 1/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
EPHB4 P54760 1/20 0.36
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
POLB P06746 1/20 0.35
RAD52 P43351 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL697978 0.83 HSP90AA1 (0.39) KMT2AALDH1A1MAPTMEN1CYP19A1
SCHEMBL8336073 0.80 SLC6A3 (0.36) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL27899 0.80 ABCG2 (0.39) PKMCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2076685 0.80 ABCG2 (0.39) PKMCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL29352284 0.80 ABCG2 (0.39) PKMCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL5708460 0.79 TRPV1 (0.33) ALDH1A1MAPTKDM4ESMN1; SMN2HPGD
SCHEMBL5896988 0.79 NQO2 (0.38) KMT2AMEN1CYP19A1NQO2KDM4E
SCHEMBL6904608 0.78 ABCG2 (0.38) PKMCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL698217 0.77 NQO2 (0.37) KMT2AALDH1A1MAPTMEN1CYP19A1
SCHEMBL29565955 0.77 NQO2 (0.37) KMT2AALDH1A1MAPTMEN1CYP19A1

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 42 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
US-20220169600-A1 METHOD FOR PRODUCING PKROSTAGLANDIN KYOWA PHARMA CHEMICAL CO., LTD. (JP) 2022-06-02 US disclosed
EP-3199513-B1 PROCESS FOR PRODUCING ALCOHOL ANALOGUE TAKASAGO PERFUMERY CO LTD (JP) 2019-05-08 EP 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-3199513-A1 PROCESS FOR PRODUCING ALCOHOL ANALOGUE Takasago International Corporation (JP) 2017-08-02 EP disclosed
EP-2774908-B1 METHOD FOR PREVENTING DECREASE IN OPTICAL PURITY TAKASAGO PERFUMERY CO LTD (JP) 2017-02-08 EP disclosed
US-9328079-B2 Process for producing optically active amine TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-05-03 US disclosed
US-9255049-B2 Ruthenium complex and method for preparing optically active alcohol compounds using the same as a catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-02-09 US disclosed
EP-2611819-B1 IRIDIUM COMPLEX AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND TAKASAGO PERFUMERY CO LTD (JP) 2015-12-16 EP disclosed
EP-2060578-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE AMINOPHOSPHINYLBUTANOIC ACID MEIJI SEIKA KAISHA LTD. (JP) 2009-05-20 EP disclosed
US-20090036696-A1 IRIDIUM COMPLEXES TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-02-05 US disclosed
US-7462722-B2 Process for producing optically active-3-quinuclidinols TAKASAGO INTERNATIONAL CORPORATION (JP) 2008-12-09 US disclosed
EP-1935896-A1 Novel optically active biaryl phosphorus compound and production process thereof National University Corporation Tokyo University of Agriculture and Technology (JP) 2008-06-25 EP disclosed
US-20080139822-A1 Novel optically active biaryl phosphorus compound and production process thereof MAXWELL TECHNOLOGIES, INC. 2008-06-12 US disclosed
EP-1650207-B1 Process for producing optically active 3-quinuclidinols TAKASAGO PERFUMERY CO LTD (JP) 2007-06-27 EP disclosed
US-20060199973-A1 Process for producing an alcohol or a silyl ether thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-09-07 US 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
US-5872273-A LIGANDS FOR FORMING HYDROGENATION CATALYST COMPLEXES TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-02-16 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 (7 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-20090036696-A1 IRIDIUM COMPLEXES HAX1, MLX, H1-0 KMT2A 2830/4885ALDH1A1 1340/4885MAPT 4800/4885
US-20060199973-A1 Process for producing an alcohol or a silyl ether thereof CBR1, RER1, ADH1A KMT2A 765/4885ALDH1A1 534/4885MAPT 3546/4885
US-20220169600-A1 METHOD FOR PRODUCING PKROSTAGLANDIN PTGS1, PTGER1, RACK1 KMT2A 2066/4885ALDH1A1 1425/4885MAPT 4859/4885
US-20060047122-A1 Process for producing optically active-3-quinuclidinols DHPS, QDPR, TYR KMT2A 1075/4885ALDH1A1 1219/4885MAPT 1962/4885
US-20080139822-A1 Novel optically active biaryl phosphorus compound and production process thereof PHOSPHO1, DHRS9, HDHD5 KMT2A 2489/4885ALDH1A1 2036/4885MAPT 4875/4885
US-20170297990-A1 PROCESS FOR PRODUCING ALCOHOL ANALOGUE ADH1A, ADH1C, ADH5 KMT2A 1658/4885ALDH1A1 11/4885MAPT 2582/4885
US-10029968-B2 Process for producing alcohol analogue ADH1A, ADH1C, ADH5 KMT2A 1658/4885ALDH1A1 11/4885MAPT 2582/4885

“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.