SCHEMBL19636288

SCHEMBL19636288

c1ccc(C2(c3ccccc3)c3cc4[nH]c5ccccc5c4cc3-c3c2ccc2ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.42
KIF11 P52732 9/20 0.38
CDK4 P11802 3/20 0.37
CCND1 P24385 3/20 0.37
PGR P06401 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
GPR3 P46089 1/20 0.36
CCNB2 O95067 1/20 0.35
CCNE2 O96020 1/20 0.35
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
PRKCA P17252 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
GSK3B P49841 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
SCHEMBL21128638 0.89 CDK4 (0.38) CDK4CCND1ALDH1A1HSD17B10KDM4E
SCHEMBL21217588 0.87 AHR (0.42) AHRKIF11CDK4CCND1PGR
SCHEMBL19045572 0.82 AHR (0.45) AHRKIF11CDK4CCND1PGR
SCHEMBL29770912 0.82 AHR (0.45) AHRKIF11CDK4CCND1PGR
SCHEMBL783132 0.80 AHR (0.49) AHRKIF11PGRALDH1A1HSD17B10
SCHEMBL20437689 0.79 AHR (0.41) AHRKIF11PGRALDH1A1HSD17B10
SCHEMBL19573605 0.77 CDK4 (0.44) KIF11CDK4CCND1ALDH1A1HSD17B10
SCHEMBL19382781 0.76 KIF11 (0.50) KIF11CDK4CCND1PGRCCNB2
SCHEMBL15676320 0.74 MAPT (0.42) KIF11ALDH1A1HSD17B10KDM4ELMNA
SCHEMBL29557713 0.74 MAPT (0.42) KIF11ALDH1A1HSD17B10KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713291-B2 Compound for organic electronic device, organic electronic device using same, and electronic apparatus thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-08-01 US 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-2020085793-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2020-04-30 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-20190185411-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-06-20 US disclosed
US-20190131543-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-05-02 US disclosed
WO-2017200320-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF 덕산네오룩스 주식회사 2017-11-23 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-20190185411-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF PIEZO1, ORAI2, EXOC1 AHR 4162/4885KIF11 2727/4885CDK4 2877/4885
US-11713291-B2 Compound for organic electronic device, organic electronic device using same, and electronic apparatus thereof PIEZO1, ORAI2, EXOC1 AHR 4162/4885KIF11 2727/4885CDK4 2877/4885
US-20190131543-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, PIEZO1, ORAI2 AHR 3211/4885KIF11 3641/4885CDK4 1399/4885
US-20210111351-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, L1CAM, EPCAM AHR 3241/4885KIF11 2679/4885CDK4 2978/4885

“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.