SCHEMBL22823938

SCHEMBL22823938

Cc1cccc(C)c1-c1ccc2c3c(-c4ccc(C#N)cc4)c4c(cc5c6ccccc6c6cccc4c65)c(-c4ccc(C#N)cc4)c3c3cccc1c32

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ AR P10275 1/20 0.32
▸ SLC11A2 P49281 1/20 0.32
▸ GRM2 Q14416 1/20 0.31
▸ TNKS O95271 1/20 0.31
▸ CHEK1 O14757 1/20 0.31
▸ CTSA P10619 1/20 0.31
▸ APOB P04114 1/20 0.30
▸ MTTP P55157 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
SCHEMBL23348927 1.00 ALDH1A1 (0.36) ALDH1A1ATMARSLC11A2GRM2
SCHEMBL14140044 0.91 ALDH1A1 (0.41) ALDH1A1ATMARCHEK1
SCHEMBL14140040 0.91 ALDH1A1 (0.41) ALDH1A1ATMARCHEK1
SCHEMBL23349053 0.91 MEN1 (0.31) ALDH1A1
SCHEMBL23349052 0.91 MEN1 (0.31) ALDH1A1
SCHEMBL22653046 0.88 ALDH1A1 (0.36) ALDH1A1ATM
SCHEMBL24766894 0.88 ALDH1A1 (0.38) ALDH1A1ATMARCHEK1
SCHEMBL14139947 0.87 ALDH1A1 (0.38) ALDH1A1ATMARTNKS
SCHEMBL14139948 0.87 ALDH1A1 (0.38) ALDH1A1ATMARTNKS
SCHEMBL14140069 0.86 ALDH1A1 (0.36) ALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139417-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2021-05-13 — — US disclosed
US-20200403173-A1 ORGANIC LIGHT EMITTING ELEMENT, AND DISPLAY APPARATUS, IMAGE PICKUP APPARATUS, ILLUMINATION APPARATUS, AND MOVING OBJECT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2020-12-24 — — 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 (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-20210139417-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, POU2F1, NFE2L2 ALDH1A1 252/4885ATM 3521/4885AR 2147/4885

“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.

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