SCHEMBL24144465

SCHEMBL24144465

CCCn1cc(CCN)c2ccc(-c3ccncc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NR1D1 P20393 6/20 0.48
▸ METAP2 P50579 3/20 0.42
▸ AAK1 Q2M2I8 2/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ CHEK1 O14757 1/20 0.37
▸ ICMT O60725 2/20 0.36
▸ HTR6 P50406 2/20 0.36
▸ GRM2 Q14416 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
SCHEMBL24143743 0.90 NR1D1 (0.50) NR1D1METAP2AAK1HTR2ACHEK1
SCHEMBL24143870 0.87 NR1D1 (0.46) NR1D1METAP2AAK1HTR2ACHEK1
SCHEMBL24143542 0.87 NR1D1 (0.53) NR1D1AAK1HTR2A
SCHEMBL24143664 0.84 NR1D1 (0.44) NR1D1METAP2AAK1HTR2ACHEK1
SCHEMBL24142882 0.84 HTR6 (0.44) NR1D1HTR2AHTR6
SCHEMBL24143036 0.84 HTR2A (0.54) NR1D1METAP2AAK1HTR2ACHEK1
SCHEMBL24142979 0.84 NR1D1 (0.67) NR1D1ICMT
SCHEMBL24144346 0.84 NR1D1 (0.44) NR1D1METAP2AAK1HTR2ACHEK1
SCHEMBL24144078 0.81 NR1D1 (0.48) NR1D1METAP2CHEK1ICMT
SCHEMBL24144070 0.81 HTR6 (0.54) NR1D1ICMTHTR6

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-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-10-26 — — US disclosed
US-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-10-26 — — US disclosed
WO-2021263278-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS THE SCRIPPS RESEARCH INSTITUTE (US) 2021-12-30 — — 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-20230339886-A1 REV-ERB AGONISTS FOR THE TREATMENT OF TH17-MEDIATED INFLAMMATORY DISORDERS NR1H2, NR1H3, NR1D1 NR1D1 3/4885METAP2 4358/4885AAK1 2696/4885

“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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