SCHEMBL24772162

SCHEMBL24772162

Cc1cccc(Nc2cc3c(cc2C)C(C)(C)CCC3(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.46
▸ GRM5 P41594 2/20 0.40
▸ AKR1C3 P42330 2/20 0.40
▸ AKR1C2 P52895 2/20 0.40
▸ NFKB1 P19838 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 3/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ KAT2B Q92831 1/20 0.37

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
SCHEMBL23927549 0.83 KIF11 (0.41) BRD4
SCHEMBL23444958 0.83 KIF11 (0.41) MEN1KMT2AHNF4A
SCHEMBL28481448 0.83 EGFR (0.42) MAPTMEN1KMT2ARAB9AHNF4A
SCHEMBL23371572 0.83 CYP26A1 (0.44) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL23442477 0.82 NPSR1 (0.47) NPSR1GRM5AKR1C3AKR1C2MAPT
SCHEMBL29760994 0.81 GAA (0.37) NPSR1MEN1KMT2AHNF4A
SCHEMBL24561834 0.81 GAA (0.37) NPSR1MEN1KMT2AHNF4A
SCHEMBL23927691 0.80 RXRA (0.41) MEN1KMT2A
SCHEMBL23439405 0.79 CYP26A1 (0.42) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL23421097 0.78 CYP26A1 (0.38) MEN1KMT2ACYP1A2CYP3A4CYP2C9

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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2023-01-05 — — US disclosed
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2022-12-15 — — 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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT CYBA, CRY1, CYP1A1 NPSR1 3638/4885GRM5 4649/4885AKR1C3 831/4885
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, AHR, CYP1B1 NPSR1 3047/4885GRM5 4692/4885AKR1C3 554/4885

“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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