SCHEMBL21885155

SCHEMBL21885155

Clc1cccc2[nH]c(-c3ccccc3)c(-c3ccccc3)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.56
ESR2 Q92731 4/20 0.56
TUBB4A P04350 3/20 0.47
TUBB P07437 3/20 0.47
TUBA3C P0DPH7 3/20 0.47
TUBA1B P68363 3/20 0.47
TUBA4A P68366 3/20 0.47
TUBB4B P68371 3/20 0.47
TUBB3 Q13509 3/20 0.47
TUBB2A Q13885 3/20 0.47
TUBB8 Q3ZCM7 3/20 0.47
TUBA3E Q6PEY2 3/20 0.47
TUBA1A Q71U36 3/20 0.47
TUBA1C Q9BQE3 3/20 0.47
TUBB6 Q9BUF5 3/20 0.47
TUBB2B Q9BVA1 3/20 0.47
TUBB1 Q9H4B7 3/20 0.47
DYRK1A Q13627 2/20 0.43
EGFR P00533 1/20 0.43
CYP19A1 P11511 1/20 0.42

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
SCHEMBL7038627 0.85 ESR1 (0.58) ESR1ESR2TUBB4ATUBBTUBA3C
SCHEMBL21819747 0.84 ESR1 (0.42) ESR1ESR2TUBB4ATUBBTUBA3C
SCHEMBL28983296 0.84 ESR1 (0.58) ESR1ESR2EGFRCYP19A1PTGS2
SCHEMBL7042649 0.79 ESR1 (0.56) ESR1ESR2EGFRPTGS2KDM4E
SCHEMBL15617244 0.75 DYRK1A (0.62) ESR1ESR2TUBB4ATUBBTUBA3C
SCHEMBL2490337 0.75 KDM4E (0.63) ESR1ESR2PTGS2MAP2KDM4E
SCHEMBL6009055 0.73 ERCC5 (0.53) DYRK1AGPR17PBRM1GABRPGABRD
SCHEMBL31619545 0.73 ERCC5 (0.53) DYRK1AGPR17PBRM1GABRPGABRD
SCHEMBL29799621 0.72 ESR1 (1.00) ESR1ESR2EGFRCYP19A1PTGS2
SCHEMBL3864662 0.72 ESR1 (1.00) ESR1ESR2EGFRCYP19A1PTGS2

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-11737355-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-22 US disclosed
US-11737355-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-22 US disclosed
US-20200106022-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-04-02 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-20200106022-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE MAOA, PNMT, TPH1 ESR1 594/4885ESR2 1842/4885TUBB4A 3194/4885
US-11737355-B2 Organic electroluminescence device and amine compound for organic electroluminescence device MAOA, PNMT, TPH1 ESR1 594/4885ESR2 1842/4885TUBB4A 3194/4885

“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.