SCHEMBL3245486

SCHEMBL3245486

Cc1ccc2c(c1)C(C)(C)C1(C=Cc3ccc([N+](=O)[O-])cc3)OC(=O)CN21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ NFE2L2 Q16236 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ PTGS2 P35354 3/20 0.36

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
SCHEMBL3245488 1.00 KMT2A (0.38) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3255392 1.00 KMT2A (0.38) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3249753 0.86 NPSR1 (0.41) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3249758 0.86 NPSR1 (0.41) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3249754 0.86 NPSR1 (0.41) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3240716 0.85 ALDH1A1 (0.38) KMT2ARAB9AMEN1HTTALDH1A1
SCHEMBL3254651 0.85 ALDH1A1 (0.38) KMT2ARAB9AMEN1HTTALDH1A1
SCHEMBL3247998 0.84 KMT2A (0.42) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3254749 0.84 KMT2A (0.42) KMT2ARAB9AMEN1HTTSMN1; SMN2
SCHEMBL3248001 0.84 KMT2A (0.42) KMT2ARAB9AMEN1HTTSMN1; SMN2

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1747774-B1 Use of a composition comprising a colouring agent of the styrylic or imino type for dyeing keratinuous fibres OREAL (FR) 2010-05-05 — — EP claimed
US-7585332-B2 Composition containing a styryl or imine type dye and a thiol compound, hair coloring process and device L'OREAL S.A. (FR) 2009-09-08 — — US claimed
EP-2083790-A2 DYEING PROCESS USING A DYE OF STYRYL OR IMINE TYPE IN COMBINATION WITH A WEAK ACID AND DEVICE FOR IMPLEMENTING THE PROCESS L'Oreal (FR) 2009-08-05 — — EP claimed
EP-2083923-A2 COMPOSITION COMPRISING A DYE OF STYRYL OR IMINE TYPE AND A THIOL COMPOUND, DYEING PROCESS AND DEVICE L'Oreal (FR) 2009-08-05 — — EP claimed
US-7399319-B2 Dyeing composition comprising a dye chosen from styryl and imine dyes and methods for dyeing keratin fibers L'OREAL S.A. (FR) 2008-07-15 — — US claimed
WO-2008043967-A2 DYEING PROCESS USING A DYE OF STYRYL OR IMINE TYPE IN COMBINATION WITH A WEAK ACID AND DEVICE FOR IMPLEMENTING THE PROCESS L'OREAL (FR) 2008-04-17 — — WO claimed
WO-2008043968-A2 COMPOSITION COMPRISING A DYE OF STYRYL OR IMINE TYPE AND A THIOL COMPOUND, DYEING PROCESS AND DEVICE L'OREAL (FR) 2008-04-17 — — WO claimed
US-20070174977-A1 Dyeing composition comprising a dye chosen from styryl and imine dyes and methods for dyeing keratin fibers L'OREAL S.A. (FR) 2007-08-02 — — US claimed
EP-1747774-A1 Use of a composition comprising a colouring agent of the styrylic or imino type for dyeing keratinuous fibres L'Oréal (FR) 2007-01-31 — — EP claimed
WO-2010128214-A1 TREATMENT OF COLORED FIBERS BY STYRYL OR IMINE COMPOUNDS IN THE PRESENCE OF ORGANIC OR INORGANIC ACIDS AND ZINC SALTS L´OREAL (FR) 2010-11-11 — — WO disclosed
EP-1747774-B1 Use of a composition comprising a colouring agent of the styrylic or imino type for dyeing keratinuous fibres OREAL (FR) 2010-05-05 — — EP disclosed
EP-2083923-B1 COMPOSITION COMPRISING A DYE OF STYRYL OR IMINE TYPE AND A THIOL COMPOUND, DYEING PROCESS AND DEVICE OREAL (FR) 2010-05-05 — — EP disclosed
US-7585332-B2 Composition containing a styryl or imine type dye and a thiol compound, hair coloring process and device L'OREAL S.A. (FR) 2009-09-08 — — US disclosed
EP-2083923-A2 COMPOSITION COMPRISING A DYE OF STYRYL OR IMINE TYPE AND A THIOL COMPOUND, DYEING PROCESS AND DEVICE L'Oreal (FR) 2009-08-05 — — EP disclosed
US-20080189878-A1 Dyeing process using a dye of styryl or imine type in combination with a weak acid, and device for implementing the process L'OREAL S.A. (FR) 2008-08-14 — — US disclosed
US-7399319-B2 Dyeing composition comprising a dye chosen from styryl and imine dyes and methods for dyeing keratin fibers L'OREAL S.A. (FR) 2008-07-15 — — US disclosed
WO-2008043967-A2 DYEING PROCESS USING A DYE OF STYRYL OR IMINE TYPE IN COMBINATION WITH A WEAK ACID AND DEVICE FOR IMPLEMENTING THE PROCESS L'OREAL (FR) 2008-04-17 — — WO disclosed
WO-2008043968-A2 COMPOSITION COMPRISING A DYE OF STYRYL OR IMINE TYPE AND A THIOL COMPOUND, DYEING PROCESS AND DEVICE L'OREAL (FR) 2008-04-17 — — WO disclosed
US-20070174977-A1 Dyeing composition comprising a dye chosen from styryl and imine dyes and methods for dyeing keratin fibers L'OREAL S.A. (FR) 2007-08-02 — — US disclosed
EP-1747774-A1 Use of a composition comprising a colouring agent of the styrylic or imino type for dyeing keratinuous fibres L'Oréal (FR) 2007-01-31 — — 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 (2 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-20080189878-A1 Dyeing process using a dye of styryl or imine type in combination with a weak acid, and device for implementing the process KRT18, INHA, IK KMT2A 809/4885RAB9A 3417/4885MEN1 2999/4885
US-20070174977-A1 Dyeing composition comprising a dye chosen from styryl and imine dyes and methods for dyeing keratin fibers KRT18, INHA, IK KMT2A 1891/4885RAB9A 3262/4885MEN1 3368/4885

“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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