SCHEMBL497181

SCHEMBL497181

NCc1ccc(N=C2N=C(N)C(=O)C=C2Nc2ccc(CN)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ BPTF Q12830 4/20 0.33
▸ BRD4 O60885 3/20 0.33
▸ APAF1 O14727 1/20 0.33
▸ MITF O75030 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ DNM1 Q05193 1/20 0.33
▸ LMNA P02545 3/20 0.31
▸ GAA P10253 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KAT2B Q92831 1/20 0.31
▸ PTK2 Q05397 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ F9 P00740 1/20 0.30
▸ F11 P03951 1/20 0.30
▸ F7 P08709 1/20 0.30
▸ CYP2C9 P11712 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
SCHEMBL497179 1.00 MAPT (0.36) MAPTSMN1; SMN2BPTFBRD4APAF1
SCHEMBL10024649 0.87 DNM1 (0.36) MAPTSMN1; SMN2BPTFAPAF1TDP1
SCHEMBL497307 0.87 DNM1 (0.36) MAPTSMN1; SMN2BPTFAPAF1TDP1
SCHEMBL497306 0.87 DNM1 (0.36) MAPTSMN1; SMN2BPTFAPAF1TDP1
SCHEMBL10024646 0.84 DNM1 (0.51) MAPTSMN1; SMN2APAF1TDP1DNM1
SCHEMBL496950 0.84 DNM1 (0.51) MAPTSMN1; SMN2APAF1TDP1DNM1
SCHEMBL496948 0.84 DNM1 (0.51) MAPTSMN1; SMN2APAF1TDP1DNM1
SCHEMBL10024643 0.84 MAPT (0.43) MAPTSMN1; SMN2TDP1DNM1LMNA
SCHEMBL496883 0.79 JAK2 (0.33) DNM1
SCHEMBL496885 0.79 JAK2 (0.33) DNM1

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
EP-2231607-B1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 2-AMINO-3-HYDROXYPYRIDINE, AND HAIR DYEING PROCESS USING THESE DYES AND PRECURSORS OREAL (FR) 2013-07-03 — — EP claimed
US-20110041262-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF AZOMETHINE DIRECT DYES OBTAINED FROM 2-ALKYLRESORCINOLS, AND HAIR DYEING PROCESS USING THESE DYES OR PRECURSORS L'OREAL S.A (FR) 2011-02-24 — — US claimed
EP-2231607-B1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 2-AMINO-3-HYDROXYPYRIDINE, AND HAIR DYEING PROCESS USING THESE DYES AND PRECURSORS OREAL (FR) 2013-07-03 — — EP disclosed
US-8105394-B2 Azomethine direct dyes or reduced precursors of azomethine direct dyes obtained from 2-alkylresorcinols, and hair dyeing process using these dyes or precursors L'OREAL S.A. (FR) 2012-01-31 — — US disclosed
US-20110041262-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF AZOMETHINE DIRECT DYES OBTAINED FROM 2-ALKYLRESORCINOLS, AND HAIR DYEING PROCESS USING THESE DYES OR PRECURSORS L'OREAL S.A (FR) 2011-02-24 — — 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-20110041262-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF AZOMETHINE DIRECT DYES OBTAINED FROM 2-ALKYLRESORCINOLS, AND HAIR DYEING PROCESS USING THESE DYES OR PRECURSORS KRT18, AKR1C4, QDPR MAPT 1558/4885SMN1; SMN2 4825/4885BPTF 2972/4885

“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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