SCHEMBL4130017

SCHEMBL4130017

FC(F)(F)c1ccc2[nH]c3ccccc3c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 13/20 1.00
CHUK O15111 1/20 0.63
AHR P35869 1/20 0.57
ALDH1A1 P00352 1/20 0.54
GPR3 P46089 1/20 0.54
HSD17B10 Q99714 1/20 0.54
KDM4E B2RXH2 1/20 0.53
PGR P06401 1/20 0.50
CDK4 P11802 1/20 0.49
CCND1 P24385 1/20 0.49

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
SCHEMBL29507666 0.90 KIF11 (0.81) KIF11CHUKKDM4E
SCHEMBL412032 0.90 KIF11 (0.81) KIF11CHUKKDM4E
SCHEMBL4126997 0.89 KIF11 (1.00) KIF11AHRALDH1A1GPR3HSD17B10
SCHEMBL607944 0.86 KIF11 (0.75) KIF11CHUKAHRALDH1A1GPR3
SCHEMBL25012836 0.82 KIF11 (0.70) KIF11CHUKKDM4E
SCHEMBL19967918 0.82 KIF11 (0.70) KIF11CHUKKDM4ECDK4CCND1
SCHEMBL28071967 0.82 KIF11 (0.69) KIF11CHUKAHRALDH1A1GPR3
SCHEMBL27936896 0.81 KIF11 (0.68) KIF11ALDH1A1GPR3HSD17B10KDM4E
SCHEMBL29363588 0.81 KIF11 (1.00) KIF11AHRALDH1A1GPR3HSD17B10
SCHEMBL10090582 0.81 KIF11 (1.00) KIF11AHRALDH1A1GPR3HSD17B10

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023013697-A1 MATERIAL FOR METAL PATTERNING, FLUORO COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENCE DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2023-02-09 WO disclosed
WO-2023013697-A1 MATERIAL FOR METAL PATTERNING, FLUORO COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENCE DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2023-02-09 WO disclosed
US-11276825-B2 Organic molecules for use in organic devices CYNORA GMBH (DE) 2022-03-15 US disclosed
US-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-17 US disclosed
EP-3279193-B1 COMPOUNDS COMPRISING A PHTHALIMIDE GROUP AND CARBAZOLE OR ITS ANALOGUES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-05-08 EP disclosed
CN-109661390-A The compound containing phthalimide and carbazole or its analog for organic photoelectric device 辛诺拉有限公司 2019-04-19 CN disclosed
US-9994577-B2 Azepanyl-derivatives and pharmaceutical compositions comprising the same with antiparasitic activity MERCK PATENT GMBH (DE) 2018-06-12 US disclosed
US-9994577-B2 Azepanyl-derivatives and pharmaceutical compositions comprising the same with antiparasitic activity MERCK PATENT GMBH (DE) 2018-06-12 US disclosed
US-20180072945-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND LIGHTING DEVICE MERCK PATENT GMBH (DE) 2018-03-15 US disclosed
US-20180072945-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND LIGHTING DEVICE MERCK PATENT GMBH (DE) 2018-03-15 US disclosed
EP-3279193-A1 COMPOUNDS COMPRISING PHTHALIMIDE AND CARBAZOLE OR ITS ANALOGUES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-07 EP disclosed
US-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
US-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
CN-101941939-B Polyfunctional carbazole derivative oxime ester compound and preparation method and light polymerization initiator thereof SHENZHEN YOUWEI CHEMICAL TECHNOLOGY CO LTD 2013-05-29 CN disclosed
CN-101941939-A Polyfunctional carbazole derivative oxime ester compound and preparation method and light polymerization initiator thereof SHENZHEN YOUWEI CHEMICAL TECHNOLOGY CO LTD 2011-01-12 CN disclosed
US-20090170882-A1 Methods and compositions CYTOKINETICS, INCORPORATED 2009-07-02 US disclosed
EP-1771176-A2 METHODS AND COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-11 EP disclosed
WO-2006005063-A2 METHODS AND COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2006-01-12 WO 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 (4 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-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY ACHE, PARK7, CYP51A1 KIF11 1584/4885CHUK 4243/4885AHR 2269/4885
US-20210184134-A1 ORGANIC MOLECULES FOR USE IN ORGANIC DEVICES CHRM1, C1S, DNMT3L KIF11 4512/4885CHUK 3243/4885AHR 57/4885
US-20090170882-A1 Methods and compositions KIF5B, KIF5C, KIF2C KIF11 10/4885CHUK 3598/4885AHR 4543/4885
US-11276825-B2 Organic molecules for use in organic devices AOX1, OR10J3, L1CAM KIF11 3612/4885CHUK 4407/4885AHR 949/4885

“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.