SCHEMBL4609634

SCHEMBL4609634

CC(C)CCCc1cc(N)ccc1Nc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
GAA P10253 9/20 0.49
HTT P42858 4/20 0.49
ALOX15 P16050 4/20 0.49
TDP1 Q9NUW8 3/20 0.49
MAPT P10636 11/20 0.43
KDM4E B2RXH2 8/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
NSD2 O96028 1/20 0.43
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
APOBEC3A P31941 1/20 0.43
RECQL P46063 1/20 0.43
CASP6 P55212 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
LMNA P02545 3/20 0.39
GFER P55789 3/20 0.39
CYP1A2 P05177 2/20 0.39

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
SCHEMBL28260713 0.84 ALDH1A1 (0.53) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL30271883 0.83 GAA (0.62) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL7196552 0.82 GAA (0.50) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL6567725 0.81 GAA (0.56) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL11208844 0.77 GAA (0.59) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL30040907 0.77 GAA (0.59) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL2904304 0.76 ALDH1A1 (0.42) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL5028841 0.74 AKT1 (0.40) ALDH1A1GAAHTTTDP1MAPT
SCHEMBL30235291 0.73 GAA (0.57) ALDH1A1GAAHTTALOX15TDP1
SCHEMBL3337211 0.71 ALDH1A1 (0.51) ALDH1A1GAAHTTALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024145439-A1 POLYUREA AND METHOD OF MAKING USING AN AMINE COMPOUND SI GROUP, INC. (US) 2024-07-04 WO claimed
CN-102686412-A Tire comprising an antioxidant reservoir MICHELIN SOC TECH 2012-09-19 CN claimed
EP-1976821-A1 DIRECT ALKYLATION OF N-ALKYL-N'-PHENYL-P-PHENYLENEDIAMINE CHEMTURA CORPORATION (US) 2008-10-08 EP claimed
WO-2007087195-A1 DIRECT ALKYLATION OF N-ALKYL-N'-PHENYL-P-PHENYLENEDIAMINE CHEMTURA CORPORATION (US) 2007-08-02 WO claimed
EP-1027327-A4 FORMATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES BY CATALYTIC OXIDATION FLEXSYS AMERICA LP (US) 2000-11-29 EP claimed
EP-1030833-A4 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING A HYPOCHLORITE AS AN OXIDATION AGENT FLEXSYS AMERICA LP (US) 2000-11-29 EP claimed
EP-1042269-A4 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING HYDROGEN PEROXIDE AND A CATALYST FLEXSYS AMERICA LP (US) 2000-11-15 EP claimed
EP-1042269-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING HYDROGEN PEROXIDE AND A CATALYST FLEXSYS AMERICA L.P. (US) 2000-10-11 EP claimed
EP-1030833-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING A HYPOCHLORITE AS AN OXIDATION AGENT FLEXSYS AMERICA L.P. (US) 2000-08-30 EP claimed
EP-1027327-A1 FORMATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES BY CATALYTIC OXIDATION FLEXSYS AMERICA L.P. (US) 2000-08-16 EP claimed
WO-1999021826-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING A HYPOCHLORITE AS AN OXIDATION AGENT FLEXSYS AMERICA L.P. (US) 1999-05-06 WO claimed
WO-1999021827-A1 FORMATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES BY CATALYTIC OXIDATION FLEXSYS AMERICA L.P. (US) 1999-05-06 WO claimed
WO-1999021819-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING HYDROGEN PEROXIDE AND A CATALYST FLEXSYS AMERICA L.P. (US) 1999-05-06 WO claimed
EP-3983375-A1 LOW-POLLUTION ANTIDEGRADANT COMPOUND AND ANTIDEGRADANT COMPOSITION AND RUBBER COMPOSITION COMPRISING THE SAME FOR TIRES Sennics Co., Ltd. (CN) 2022-04-20 EP disclosed
EP-3853042-A1 RUBBER COMPOSITION COMPRISING AN EPOXIDE ELASTOMER AND A POLYPHENOLIC COMPOUND COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-07-28 EP disclosed
EP-3774395-A1 PNEUMATIC TYRE FOR ROAD VEHICLES Bridgestone Europe NV/SA (BE) 2021-02-17 EP disclosed
WO-2000037267-A1 TIRE FOR VEHICLES HAVING A HIGH WEAR RESISTANCE AND VULCANIZABLE RUBBER COMPOSITION FOR MAKING THE SAME PIRELLI PNEUMATICI S.P.A. (IT) 2000-06-29 WO disclosed
WO-1999062868-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING OXYGEN AND A METAL OR METAL SALT CATALYST FLEXSYS AMERICA L.P. (US) 1999-12-09 WO disclosed
WO-1999021826-A1 PREPARATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES USING A HYPOCHLORITE AS AN OXIDATION AGENT FLEXSYS AMERICA L.P. (US) 1999-05-06 WO disclosed
WO-1999021827-A1 FORMATION OF QUINONEDIIMINES FROM PHENYLENEDIAMINES BY CATALYTIC OXIDATION FLEXSYS AMERICA L.P. (US) 1999-05-06 WO disclosed