SCHEMBL3877421

SCHEMBL3877421

CCCCCCCCCCCCc1ccc(Br)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
KCNH2 Q12809 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SHBG P04278 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
HSPD1 P10809 1/20 0.38
ADRB3 P13945 1/20 0.38
HTR2C P28335 1/20 0.38
HSPE1 P61604 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL20122066 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL1756488 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL3076471 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL1304794 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL15791269 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL3883593 1.00 KDM4E (0.40) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL3357183 0.98 TDP1 (0.41) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL3870601 0.92 KDM4E (0.42) KDM4ETDP1ALDH1A1HSD17B10POLB
SCHEMBL10005497 0.89 KDM4E (0.36) KDM4ETDP1ESR1ADRA2AADORA3
SCHEMBL21980888 0.89 KDM4E (0.36) KDM4ETDP1ESR1ADRA2AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023036995-A1 ALKYNYLCARBINOLS WITH HIGH CYTOTOXICITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-03-16 WO disclosed
US-11370879-B2 Solution-processable indenofluorenes and methods to generate solution-processable indenofluorenes INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-06-28 US disclosed
CN-112500390-B Organic hole transport material, synthesis method thereof and perovskite battery 隆基绿能科技股份有限公司 2022-06-10 CN disclosed
US-11312820-B2 Solution-processable indenofluorenes and methods to generate solution-processable indenofluorenes INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-04-26 US disclosed
US-20210115187-A1 SOLUTION-PROCESSABLE INDENOFLUORENES AND METHODS TO GENERATE SOLUTION-PROCESSABLE INDENOFLUORENES INTERNATIONAL BUSINESS MACHINES CORPORATION 2021-04-22 US disclosed
CN-112500390-A Organic hole transport material, synthesis method thereof and perovskite battery 隆基绿能科技股份有限公司 2021-03-16 CN disclosed
US-20200190254-A1 SOLUTION-PROCESSABLE INDENOFLUORENES AND METHODS TO GENERATE SOLUTION-PROCESSABLE INDENOFLUORENES INTERNATIONAL BUSINESS MACHINES CORPORATION 2020-06-18 US disclosed
CN-110178241-A Photoactive layer and organic solar cell including the same 株式会社LG化学 2019-08-27 CN disclosed
CN-108780847-A ORGANIC SOLAR CELL AND METHOD FOR MANUFACTURING SAME 株式会社LG化学 2018-11-09 CN disclosed
CN-105473635-B Copolymer and organic solar cell comprising same 株式会社LG化学 2017-11-28 CN disclosed
CN-105473635-A Copolymer and organic solar cell comprising same LG CHEMICAL LTD 2016-04-06 CN disclosed
CN-105431467-A Copolymer and organic solar cell comprising same LG CHEMICAL LTD 2016-03-23 CN disclosed
WO-2015128779-A1 HETEROACENES FOR ORGANIC ELECTRONICS BASF SE (DE) 2015-09-03 WO disclosed
CN-104321361-A Copolymer and organic solar cell using the same LG CHEMICAL LTD 2015-01-28 CN disclosed
EP-2138545-B1 USE OF PORPHYRAZINE DERIVATIVE AS SEMICONDUCTOR UNIV HIROSHIMA (JP) 2014-01-08 EP disclosed
EP-2664655-A1 Novel synthesis for 5-alkyl-2,3-dihalogenthiophenes Hiroshima University (JP) 2013-11-20 EP disclosed
CN-103242344-A Sulfur-hybridized molecular graphene compound and preparation and applications thereof UNIV DONGHUA 2013-08-14 CN disclosed
EP-2138545-A1 NOVEL PORPHYRAZINE DERIVATIVE AND INTERMEDIATE THEREOF, METHOD FOR PRODUCTION OF NOVEL PORPHYRAZINE DERIVATIVE AND INTERMEDIATE THEREOF, AND USE OF PORPHYRAZINE DERIVATIVE Hiroshima University (JP) 2009-12-30 EP disclosed
US-7408188-B2 Organic semiconductor material, organic semiconductor structure and organic semiconductor apparatus DAI NIPPON PRINTING CO., LTD. (JP) 2008-08-05 US disclosed
US-20070045614-A1 Organic semiconductor material, organic semiconductor structure and organic semiconductor apparatus DAI NIPPON PRINTING CO., LTD. (JP) 2007-03-01 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 (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-11370879-B2 Solution-processable indenofluorenes and methods to generate solution-processable indenofluorenes INF2, ABL1, ICMT KDM4E 2475/4885TDP1 2065/4885ESR1 58/4885
US-11312820-B2 Solution-processable indenofluorenes and methods to generate solution-processable indenofluorenes INF2, ABL1, ICMT KDM4E 2475/4885TDP1 2065/4885ESR1 58/4885
US-20210115187-A1 SOLUTION-PROCESSABLE INDENOFLUORENES AND METHODS TO GENERATE SOLUTION-PROCESSABLE INDENOFLUORENES INF2, ABL1, ICMT KDM4E 2475/4885TDP1 2065/4885ESR1 58/4885
US-20200190254-A1 SOLUTION-PROCESSABLE INDENOFLUORENES AND METHODS TO GENERATE SOLUTION-PROCESSABLE INDENOFLUORENES INF2, ABL1, ICMT KDM4E 2475/4885TDP1 2065/4885ESR1 58/4885

“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.