SCHEMBL1911832

SCHEMBL1911832

COc1cc(N)c(Cl)c(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.50
▸ CYP3A4 P08684 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ THRB P10828 2/20 0.50
▸ GAA P10253 4/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ G6PD P11413 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL15883267 0.84 ALDH1A1 (0.53) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL6189730 0.80 ALDH1A1 (0.43) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL10945773 0.80 GAA (0.48) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL16009653 0.78 ALDH1A1 (0.44) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL17736226 0.78 ALDH1A1 (0.52) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL18395150 0.78 POLB (0.43) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL16134065 0.78 ALDH1A1 (0.42) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL2841590 0.77 ALDH1A1 (0.54) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL10948454 0.77 NPC1 (0.56) ALDH1A1CYP3A4MEN1MAPTKMT2A
SCHEMBL16659617 0.77 CYP3A4 (0.50) ALDH1A1CYP3A4MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220332687-A1 HETEROARYL COMPOUNDS AND USES THEREOF SANOFI (FR) 2022-10-20 — — US disclosed
US-20220332687-A1 HETEROARYL COMPOUNDS AND USES THEREOF SANOFI (FR) 2022-10-20 — — US disclosed
US-20220135544-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2022-05-05 — — US disclosed
EP-3943087-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2022-01-26 — — EP disclosed
EP-3943087-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2022-01-26 — — EP disclosed
EP-3421457-B1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MAN CO LTD (JP) 2021-10-06 — — EP disclosed
EP-3421457-B1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MAN CO LTD (JP) 2021-10-06 — — EP disclosed
EP-2968337-B1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE CAR LLC (BM) 2021-07-21 — — EP disclosed
EP-2968337-B1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE CAR LLC (BM) 2021-07-21 — — EP disclosed
US-10912774-B2 Pyrimidine FGFR4 inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-02-09 — — US disclosed
EP-1472231-A1 2'-HALO-3',5'-DIALKOXYPHEN-1'-YL-IMINO-2-IMIDAZOLIDINE DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF URINARY INCONTINENCE Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-11-03 — — EP disclosed
US-6703409-B2 NITROGEN COMPOUNDS SUCH AS 2'-CHLORO-3',5'-DIMETHOXYPHEN-1'-YL -IMINO-2-IMIDAZOLIDINE OR ISOMERS, USED AS PREFERENTIAL ADRENOCEPTOR AGONISTS FOR PREVENTION OF INCONTINENCE; SIDE EFFECT REDUCTION BOEHRINGER INGELHEIM PHARMA GMBH & CO KG (DE) 2004-03-09 — — US disclosed
US-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation DOBRUSIN ELLEN MYRA (US) 2004-03-04 — — US disclosed
US-20030162822-A1 2'-Halo-3',5'-dialkoxyphen-1'-yl-imino-2-imidazolidine and the use thereof as a drug BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-08-28 — — US disclosed
WO-2003064398-A1 2'-HALO-3',5'-DIALKOXYPHEN-1'-YL-IMINO-2-IMIDAZOLIDINE DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF URINARY INCONTINENCE BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-08-07 — — WO disclosed
EP-1333028-A1 2'-Halo-3',5'-dialkoxyphen-1'-yl-imino-2-imidazolidine derivatives and the use thereof for the treatment of urinary incontinence Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-08-06 — — EP disclosed
EP-1080092-A2 BICYCLIC PYRIMIDINES AND BICYCLIC 3,4-DIHYDROPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 2001-03-07 — — EP disclosed
WO-1999061444-A2 BICYCLIC PYRIMIDINES AND BICYCLIC 3,4-DIHYDROPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-02 — — WO disclosed
EP-0304057-B1 Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO (JP) 1994-04-20 — — EP disclosed
EP-0304057-A2 Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-02-22 — — 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-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation CCNI, CCNH, CCNA1 ALDH1A1 2575/4885CYP3A4 2628/4885MEN1 4287/4885
US-20220332687-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 ALDH1A1 684/4885CYP3A4 6/4885MEN1 606/4885
US-20030162822-A1 2'-Halo-3',5'-dialkoxyphen-1'-yl-imino-2-imidazolidine and the use thereof as a drug ADRA2C, CLIC1, WNK3 ALDH1A1 1076/4885CYP3A4 214/4885MEN1 1825/4885
US-10912774-B2 Pyrimidine FGFR4 inhibitors FGFR4, FGFR1, FGFR3 ALDH1A1 1012/4885CYP3A4 929/4885MEN1 4187/4885
US-20220135544-A1 PYRAZOLYL QUINOXALINE KINASE INHIBITORS PDXK, DCK, PDPK1 ALDH1A1 3245/4885CYP3A4 1555/4885MEN1 1345/4885

“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.

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