SCHEMBL11245166

SCHEMBL11245166

CC1=C(C)C(=O)N(c2cccc(C(=O)O)c2C(=O)O)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 4/20 0.47
NR4A1 P22736 1/20 0.45
KMT2A Q03164 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
APEX1 P27695 2/20 0.42
ALDH1A1 P00352 5/20 0.42
ALOX15 P16050 1/20 0.42
POLB P06746 2/20 0.41
AKR1C3 P42330 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PARP1 P09874 1/20 0.41
PARP15 Q460N3 1/20 0.41
PARP10 Q53GL7 1/20 0.41
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 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
SCHEMBL11511736 0.88 MYC (0.43) MYCNR4A1KMT2ACYP3A4CYP2C9
SCHEMBL11510114 0.88 MYC (0.41) MYCNR4A1KMT2ACYP3A4CYP2C9
SCHEMBL8889877 0.84 MYC (0.58) MYCNR4A1KMT2AAPEX1ALDH1A1
SCHEMBL27873776 0.83 APEX1 (0.56) MYCAPEX1ALDH1A1ALOX15POLB
Hydrochloric Acid SCHEMBL7461209 0.83 MYC (0.56) MYCNR4A1KMT2AAPEX1ALDH1A1
SCHEMBL10935998 0.79 TLR9 (0.56) MYCAPEX1ALDH1A1ALOX15POLB
SCHEMBL11564833 0.78 ALDH1A1 (0.43) MYCNR4A1KMT2AAPEX1ALDH1A1
SCHEMBL11563899 0.75 GAA (0.47) MYCNR4A1KMT2ACYP3A4CYP2C9
SCHEMBL11427999 0.75 MYC (0.41) MYCNR4A1CYP2C9APEX1ALDH1A1
SCHEMBL11565052 0.74 ALDH1A1 (0.36) MYCNR4A1KMT2AAPEX1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365068-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1982-12-21 US disclosed
US-4280946-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1981-07-28 US disclosed
US-4219481-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1980-08-26 US disclosed
US-4210588-A ADHESION PROMOTERS BETWEEN INORGANIC SOLIDS AND ORGANIC RESINS CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed
US-4210588-A ADHESION PROMOTERS BETWEEN INORGANIC SOLIDS AND ORGANIC RESINS CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed
US-4160081-A Imidyl- and isoimidyl-phthalic anhydrides, process for their manufacture and their use for curing epoxide resins CIBA-GEIGY CORPORATION (US) 1979-07-03 US disclosed
US-4131613-A CURING AGENTS FOR EPOXIDE RESINS CIBA-GEIGY CORPORATION (US) 1978-12-26 US disclosed
US-4126619-A CROSSLINKABLE BIS-IMIDYL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-11-21 US disclosed
US-3979393-A Imidyl- and isoimidyl-phthalic anhydrides, process for their manufacture and their use for curing epoxide resins CIBA-GEIGY CORPORATION (US) 1976-09-07 US disclosed