SCHEMBL9178309

SCHEMBL9178309

O=C1C=C(O)C(=O)c2cc(O)c(O)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 6/20 0.48
MCL1 Q07820 6/20 0.48
KDM4E B2RXH2 3/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.40
POLB P06746 2/20 0.39
RECQL P46063 2/20 0.39
KMT2A Q03164 2/20 0.39
ATM Q13315 1/20 0.39
USP2 O75604 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
XIAP P98170 1/20 0.38
MEN1 O00255 1/20 0.36
PABPC1 P11940 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ESR1 P03372 1/20 0.34

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
SCHEMBL18992102 0.82 KDM4E (0.38) BCL2MCL1KDM4EMAPTALDH1A1
SCHEMBL30002673 0.82 XIAP (0.39) KDM4EMAPTALDH1A1CYP3A4HPGD
SCHEMBL30003252 0.82 KDM4E (0.38) BCL2MCL1KDM4EMAPTALDH1A1
SCHEMBL8993580 0.82 XIAP (0.39) KDM4EMAPTALDH1A1CYP3A4HPGD
SCHEMBL6683984 0.79 GAPDH (0.49) BCL2MCL1KDM4EMAPTALDH1A1
SCHEMBL973797 0.77 CA1 (0.46) CYP3A4XIAPP4HB
SCHEMBL8821657 0.76 BCL2 (0.74) BCL2MCL1MAPTALDH1A1CYP3A4
SCHEMBL5817037 0.76 ESR2 (0.61) KDM4EMAPTALDH1A1CYP3A4HPGD
SCHEMBL5811756 0.76 ESR2 (0.61) BCL2MCL1KDM4EMAPTALDH1A1
SCHEMBL30004162 0.76 ESR2 (0.61) BCL2MCL1KDM4EMAPTALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0498707-B1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent OREAL (FR) 1995-08-02 EP claimed
EP-0498707-A1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent L'OREAL (FR) 1992-08-12 EP claimed
US-4888026-A HAIR DYES; OXIDATION RESISTANCE L'OREAL (FR) 1989-12-19 US claimed
EP-0498707-B1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent OREAL (FR) 1995-08-02 EP disclosed
US-5275626-A Hair dyes L'OREAL (FR) 1994-01-04 US disclosed
EP-0498707-A1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent L'OREAL (FR) 1992-08-12 EP disclosed
US-4888026-A HAIR DYES; OXIDATION RESISTANCE L'OREAL (FR) 1989-12-19 US disclosed