SCHEMBL19035989

SCHEMBL19035989

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6cc(-c8ccc9c(c8)c8ccccc8n9-c8ccc9c(c8)Oc8cc(-c%10cc%11c%12c(c%10)Oc%10ccccc%10N%12c%10ccccc%10O%11)cc%10c8N9c8ccccc8O%10)ccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 4/20 0.40
EDNRB P24530 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC4 P56524 1/20 0.31
PTGER4 P35408 1/20 0.30

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
SCHEMBL19036007 0.97 KDM4E (0.38) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL22958756 0.97 L3MBTL1 (0.42) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL19035997 0.96 KDM4E (0.38) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL19035949 0.96 KDM4E (0.41) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL22958706 0.94 L3MBTL1 (0.40) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL19035994 0.94 L3MBTL1 (0.42) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL12333547 0.94 L3MBTL1 (0.44) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL22958722 0.93 L3MBTL1 (0.43) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL19035995 0.93 KDM4E (0.43) EDNRAEDNRBKDM4EATML3MBTL1
SCHEMBL19035941 0.92 L3MBTL1 (0.44) EDNRAEDNRBKDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10336772-B2 Bicarbazole compound, material for organic light-emitting device including bicarbazole compound, and organic light-emitting device including bicarbazole compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-02 US disclosed
US-20170183360-A1 BICARBAZOLE COMPOUND, MATERIAL FOR ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-06-29 US disclosed
US-20170183360-A1 BICARBAZOLE COMPOUND, MATERIAL FOR ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-06-29 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 (2 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-10336772-B2 Bicarbazole compound, material for organic light-emitting device including bicarbazole compound, and organic light-emitting device including bicarbazole compound BRD1, CYP1B1, ARL1 EDNRA 2966/4885EDNRB 3370/4885KDM4E 4064/4885
US-20170183360-A1 BICARBAZOLE COMPOUND, MATERIAL FOR ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING BICARBAZOLE COMPOUND BRD1, CYP1B1, ARL1 EDNRA 2966/4885EDNRB 3370/4885KDM4E 4064/4885

“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.