SCHEMBL25848930

SCHEMBL25848930

Cc1cc(-c2ccnc(Cl)c2C=O)cc(C)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2D6 P10635 2/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ KMO O15229 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL22167071 0.81 ERN1 (0.33) KMOERN1
SCHEMBL25848923 0.81 DYRK1A (0.32) MTOR
SCHEMBL22167063 0.79 PTGS2 (0.35) ALDH1A1KMT2A
SCHEMBL25669642 0.76 TDP1 (0.40) ALDH1A1CYP3A4KDM4EMAPTKMO
SCHEMBL8550487 0.76 MEN1 (0.39) ALDH1A1KDM4EMAPTNPSR1L3MBTL1
SCHEMBL15911817 0.75 ERN1 (0.49) CYP3A4KDM4EMAPTHTTADORA2A
SCHEMBL24037444 0.74 TLR8 (0.35) ALDH1A1KDM4EHPGDERN1KMT2A
SCHEMBL15893291 0.73 KIF11 (0.41) ALDH1A1KDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL23557303 0.73 ABL1 (0.43) ERN1
SCHEMBL22167049 0.73 S1PR1 (0.42) —

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-20230227486-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2023-07-20 — — US disclosed
US-20230227486-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2023-07-20 — — 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-20230227486-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT SOD1, LEF1, ORC3 MTOR 2848/4885ALDH1A1 1078/4885CYP3A4 800/4885

“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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