SCHEMBL3079657

SCHEMBL3079657

Brc1ccc(C(c2ccc(I)cc2)(c2ccc(I)cc2)c2ccc(I)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.42
APP P05067 2/20 0.42
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA5A P35218 1/20 0.35
CA9 Q16790 1/20 0.35
CNR1 P21554 1/20 0.34
ALDH1A1 P00352 4/20 0.33
ALOX15 P16050 2/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 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
SCHEMBL3092338 1.00 CYP2A6 (0.42) CYP2A6APPCA1CA2CA5A
SCHEMBL10033199 0.89 ALDH1A1 (0.54) CYP2A6APPCA1CA2CA5A
SCHEMBL13701491 0.89 ALDH1A1 (0.54) CYP2A6APPCA1CA2CA5A
SCHEMBL28553350 0.86 APP (0.40) APPCA1CA2
SCHEMBL1986810 0.86 APP (0.40) APPCA1CA2
SCHEMBL440244 0.86 CYP2A6 (0.57) CYP2A6CA1CA2CA5ACA9
SCHEMBL28912876 0.86 CYP2A6 (0.57) CYP2A6CA1CA2CA5ACA9
SCHEMBL455656 0.83 CYP2A6 (0.61) CYP2A6APPCA1CA2CNR1
SCHEMBL8068361 0.83 CYP2A6 (0.61) CYP2A6APPCA1CA2CNR1
SCHEMBL24146 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217902-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2024-07-04 US disclosed
US-20240217902-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2024-07-04 US disclosed
US-11877508-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2024-01-16 US disclosed
US-11877508-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2024-01-16 US disclosed
US-20230200214-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-06-22 US disclosed
US-20230200214-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-06-22 US disclosed
US-20230189636-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-06-15 US disclosed
WO-2023282511-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-12 WO disclosed
US-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 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 (5 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-20230189636-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF EMC1, EMC2, EPCAM CYP2A6 2104/4885APP 3686/4885CA1 1802/4885
US-20230200214-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF EMC1, EMC2, EPCAM CYP2A6 2104/4885APP 3686/4885CA1 1802/4885
US-11877508-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof EMC1, EMC2, EPCAM CYP2A6 2104/4885APP 3686/4885CA1 1802/4885
US-20240217902-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF EMC1, EMC2, AOC1 CYP2A6 2151/4885APP 3765/4885CA1 1591/4885
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND PAH, TSNAX, ZFX CYP2A6 1523/4885APP 971/4885CA1 809/4885

“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.