SCHEMBL3854963

SCHEMBL3854963

Cc1c(/N=C2/C=C(OCCO)C(=N)C=C2N)c(=O)n(-c2ccccc2)n1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 6/20 0.47
▸ MAPT P10636 11/20 0.47
▸ ALDH1A1 P00352 7/20 0.47
▸ GAA P10253 6/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ HTT P42858 4/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ MPI P34949 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ MITF O75030 1/20 0.47
▸ NSD2 O96028 1/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ LMNA P02545 4/20 0.47
▸ TDP1 Q9NUW8 3/20 0.45
▸ G6PD P11413 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ THRB P10828 2/20 0.45
▸ TP53 P04637 1/20 0.45

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
SCHEMBL3854967 1.00 MAPK1 (0.47) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL13679917 1.00 MAPK1 (0.47) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3853101 0.87 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3853099 0.87 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3859873 0.83 MAPT (0.59) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3859871 0.83 MAPT (0.59) MAPK1MAPTALDH1A1GAAMEN1
Perchlorate SCHEMBL3863336 0.82 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1
Perchlorate SCHEMBL3863334 0.82 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3853825 0.81 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1
SCHEMBL3853822 0.81 MAPT (0.53) MAPK1MAPTALDH1A1GAAMEN1

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-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
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 MAPK1 814/4885MAPT 308/4885ALDH1A1 729/4885

“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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