SCHEMBL23024877

SCHEMBL23024877

Clc1ccc2sc3c4ccccc4ccc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 5/20 0.51
▸ CYP1B1 Q16678 5/20 0.51
▸ CYP1A2 P05177 3/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ CYP2A6 P11509 2/20 0.42
▸ PIM1 P11309 5/20 0.40
▸ PIM2 Q9P1W9 3/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ HPRT1 P00492 1/20 0.38
▸ AKR1B1 P15121 2/20 0.37
▸ AHR P35869 1/20 0.36
▸ PKM P14618 1/20 0.36

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
SCHEMBL25733722 0.89 KDM4E (0.50) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL22172198 0.88 CYP1B1 (0.52) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL24888400 0.88 KDM4E (0.51) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL23314510 0.88 CYP1A1 (0.51) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL13562027 0.87 CYP2A6 (0.44) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL24156104 0.85 CYP1B1 (0.59) CYP1A1CYP1B1CYP1A2KDM4EPIM1
SCHEMBL22650689 0.85 KDM4E (0.47) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL29344301 0.83 CYP1B1 (0.47) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL25733726 0.83 CYP1A1 (0.48) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6
SCHEMBL12070495 0.82 CYP1B1 (0.49) CYP1A1CYP1B1CYP1A2KDM4ECYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 — — US disclosed
US-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 — — US disclosed
WO-2023287228-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2023-01-19 — — WO disclosed
US-20220416174-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-12-29 — — US disclosed
WO-2022045743-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-03-03 — — WO disclosed
WO-2021033970-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 — — 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 (1 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-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, NR1D1 CYP1A1 8/4885CYP1B1 43/4885CYP1A2 55/4885

“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.

Send feedback