SCHEMBL3804671

SCHEMBL3804671

CN(C)CCc1c(N)c(=O)n(C)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 7/20 0.46
▸ KDM4E B2RXH2 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ EGFR P00533 4/20 0.41
▸ SRC P12931 1/20 0.41
▸ TOP2A P11388 2/20 0.41
▸ PABPC1 P11940 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ STAT6 P42226 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTR7 P34969 1/20 0.39

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
SCHEMBL14560451 0.75 HTR6 (0.47) HTR6KDM4EALDH1A1MAPTEGFR
SCHEMBL3194924 0.74 GPR3 (0.52) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL2758314 0.74 HTR6 (0.45) HTR6KDM4EALDH1A1HPGDHSD17B10
SCHEMBL11862746 0.71 KDM4E (0.48) HTR6KDM4EALDH1A1HPGDHSD17B10
SCHEMBL3804672 0.71 ERCC1 (0.41) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL5095637 0.70 HTR6 (0.57) HTR6TOP2AHTR7
SCHEMBL25936308 0.70 TOP2A (0.58) HTR6KDM4EALDH1A1HSD17B10TOP2A
SCHEMBL31223937 0.68 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL11861730 0.68 HTR6 (0.42) HTR6KDM4EALDH1A1HPGDHSD17B10
SCHEMBL518267 0.67 HTR6 (0.48) HTR6HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 — — US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 — — US disclosed
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma CHIRON CORPORATION 2005-11-24 — — US disclosed
US-20050256157-A1 Combination therapy with CHK1 inhibitors CHIRON CORPORATION 2005-11-17 — — US disclosed
US-20050203101-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2005-09-15 — — 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 (3 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-20050256157-A1 Combination therapy with CHK1 inhibitors CHEK1, CHEK2, RAD1 HTR6 4063/4885KDM4E 2750/4885ALDH1A1 3296/4885
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma FGFR3, FGFR1, FGFR2 HTR6 4605/4885KDM4E 3240/4885ALDH1A1 3003/4885
US-20050203101-A1 Benzimidazole quinolinones and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, PBRM1 HTR6 1857/4885KDM4E 1820/4885ALDH1A1 1196/4885

“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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