SCHEMBL17852140

SCHEMBL17852140

CC1(C)c2ccc(Br)cc2-c2ccc3ccccc3c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 3/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
APEX1 P27695 1/20 0.38
RECQL P46063 1/20 0.38
DHFR P00374 2/20 0.36
PTPRC P08575 1/20 0.34
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 6/20 0.33
CYP1A2 P05177 4/20 0.33
HPGD P15428 3/20 0.33
CYP2C19 P33261 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2C9 P11712 2/20 0.33

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
SCHEMBL29771097 0.89 CYP2A6 (0.40) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL13828968 0.89 CYP2A6 (0.40) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL29562732 0.89 CYP2A6 (0.40) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL22688452 0.89 MEN1 (0.35) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL19082478 0.85 KMT2A (0.38) KMT2AKDM4EMAPTHTTTDP1
SCHEMBL24524400 0.83 CTDSP1 (0.41) MEN1KMT2AKDM4EMAPTHTT
SCHEMBL18666251 0.83 PDK2 (0.42) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL30589364 0.83 PDK2 (0.42) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL22688453 0.82 PDK2 (0.33) CYP2A6MEN1KMT2AKDM4EMAPT
SCHEMBL29561560 0.82 PDK2 (0.41) CYP2A6MEN1KMT2APTPRCMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023063112-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT キヤノン株式会社 2023-04-20 WO disclosed
EP-3744155-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-11-02 EP disclosed
US-20210111351-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-15 US disclosed
WO-2021043755-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-03-11 WO disclosed
WO-2021045590-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2021-03-11 WO disclosed
US-20210040075-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2021-02-11 US disclosed
WO-2020231197-A1 ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-11-19 WO disclosed
WO-2019233904-A1 ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2019-12-12 WO disclosed
WO-2019145316-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-08-01 WO disclosed
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 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 (3 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-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME L1CAM, H1-10, H1-0 CYP2A6 2276/4885MEN1 1272/4885KMT2A 2098/4885
US-20210040075-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, SLCO4C1, OR10J3 CYP2A6 2206/4885MEN1 987/4885KMT2A 2436/4885
US-20210111351-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, L1CAM, EPCAM CYP2A6 2490/4885MEN1 2049/4885KMT2A 1679/4885

“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.