SCHEMBL3856509

SCHEMBL3856509

CC1=CC(=Nc2c(C)n(C)n(-c3ccccc3)c2=O)C=C(C)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 1.00
▸ GAA P10253 6/20 1.00
▸ HTT P42858 3/20 1.00
▸ MPI P34949 3/20 1.00
▸ LMNA P02545 2/20 1.00
▸ ALDH1A1 P00352 9/20 0.76
▸ MAPK1 P28482 5/20 0.76
▸ POLB P06746 3/20 0.76
▸ TDP1 Q9NUW8 2/20 0.76
▸ G6PD P11413 1/20 0.76
▸ RECQL P46063 1/20 0.76
▸ MEN1 O00255 5/20 0.74
▸ KMT2A Q03164 5/20 0.74
▸ KDM4E B2RXH2 3/20 0.74
▸ THRB P10828 2/20 0.74
▸ ATM Q13315 1/20 0.74
▸ BLM P54132 1/20 0.69
▸ TP53 P04637 1/20 0.61
▸ HSP90AA1 P07900 1/20 0.61
▸ HSP90AB1 P08238 1/20 0.61

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
SCHEMBL5508785 0.86 MAPT (0.76) MAPTGAAHTTMPILMNA
SCHEMBL3854531 0.85 MAPT (1.00) MAPTGAAHTTMPILMNA
SCHEMBL3854527 0.85 MAPT (1.00) MAPTGAAHTTMPILMNA
SCHEMBL13680051 0.85 MAPT (1.00) MAPTGAAHTTMPILMNA
SCHEMBL3864724 0.82 ALDH1A1 (1.00) MAPTGAAHTTMPILMNA
SCHEMBL13679925 0.78 MAPT (0.70) MAPTGAAHTTMPILMNA
SCHEMBL3858944 0.78 MAPT (0.70) MAPTGAAHTTMPILMNA
SCHEMBL3858947 0.78 MAPT (0.70) MAPTGAAHTTMPILMNA
SCHEMBL20122064 0.78 MAPT (0.78) MAPTGAAHTTMPILMNA
SCHEMBL13680312 0.78 MAPT (0.78) MAPTGAAHTTMPILMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582123-B2 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-09-01 — — US disclosed
US-7582123-B2 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-09-01 — — US disclosed
US-7582123-B2 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-09-01 — — US disclosed
US-20090044348-A1 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-02-19 — — US disclosed
US-20090044348-A1 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-02-19 — — US disclosed
US-20090044348-A1 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit L'OREAL S.A. (FR) 2009-02-19 — — US disclosed
EP-2011787-A1 Dying composition comprising an azomethin-type compound with a pyrazolinone moiety L'Oreal (FR) 2009-01-07 — — EP disclosed
EP-2011787-A1 Dying composition comprising an azomethin-type compound with a pyrazolinone moiety L'Oreal (FR) 2009-01-07 — — EP 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-20090044348-A1 Coloring composition comprising at least one azomethine compound with a pyrazolinone unit KRT18, KMO, TMPO MAPT 308/4885GAA 4421/4885HTT 4407/4885

“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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