SCHEMBL16426660

SCHEMBL16426660

CC1=C(Nc2ccc(N)cc2)C(=O)C=C(O)/C1=N\c1ccc(N)cc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ NR4A1 P22736 1/20 0.31
▸ DNM1 Q05193 1/20 0.31
▸ MAPT P10636 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SNCA P37840 1/20 0.30

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
SCHEMBL15020261 1.00 GAA (0.33) GAARAB9ANR4A1DNM1MAPT
SCHEMBL15020263 1.00 GAA (0.33) GAARAB9ANR4A1DNM1MAPT
SCHEMBL15020273 0.89 DNM1 (0.42) GAARAB9ADNM1MAPTALDH1A1
SCHEMBL15036632 0.89 DNM1 (0.42) GAARAB9ADNM1MAPTALDH1A1
SCHEMBL15020275 0.89 DNM1 (0.42) GAARAB9ADNM1MAPTALDH1A1
SCHEMBL15039497 0.85 DNM1 (0.35) GAARAB9ANR4A1DNM1MAPT
SCHEMBL15020957 0.82 GAA (0.32) GAARAB9A
SCHEMBL15036516 0.82 GAA (0.32) GAARAB9A
SCHEMBL15020958 0.82 GAA (0.32) GAARAB9A
SCHEMBL16426663 0.80 GAA (0.36) GAARAB9ANR4A1MAPTALDH1A1

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-9439844-B2 Tri-aromatic azomethine direct dyes comprising at least one unit derived from resorcinol, dyeing composition, method and use L'OREAL (FR) 2016-09-13 — — US disclosed
US-20150027483-A1 TRI-AROMATIC AZOMETHINE DIRECT DYES COMPRISING AT LEAST ONE UNIT DERIVED FROM RESORCINOL, DYEING COMPOSITION, METHOD AND USE L'OREAL (FR) 2015-01-29 — — 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 (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-20150027483-A1 TRI-AROMATIC AZOMETHINE DIRECT DYES COMPRISING AT LEAST ONE UNIT DERIVED FROM RESORCINOL, DYEING COMPOSITION, METHOD AND USE KRT18, IK, MKI67 GAA 4346/4885RAB9A 3779/4885NR4A1 634/4885

“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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