SCHEMBL27458124

SCHEMBL27458124

CON=C(CCOc1ccccc1C)C(=O)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 2/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
ALDH1A1 P00352 6/20 0.42
HPGD P15428 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 3/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40

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
SCHEMBL27524860 0.87 NOTUM (0.48) TDP1L3MBTL1LMNAALDH1A1NPC1
SCHEMBL8623899 0.76 TDP1 (0.39) TDP1ALDH1A1KDM4ETSHRRXRA
SCHEMBL7543566 0.75 TDP1 (0.56) TDP1LMNANPC1RAB9AHTT
SCHEMBL3046950 0.74 LMNA (0.69) TDP1L3MBTL1LMNAALDH1A1KDM4E
SCHEMBL28409661 0.73 ELANE (0.37) TDP1L3MBTL1HPGDNPC1RAB9A
SCHEMBL8622048 0.72 TDP1 (0.41) TDP1L3MBTL1ALDH1A1TSHRRXRA
SCHEMBL8619451 0.72 RXRA (0.53) TDP1L3MBTL1LMNAALDH1A1NPC1
SCHEMBL8620586 0.72 FFAR1 (0.42) L3MBTL1KDM4E
SCHEMBL28140943 0.72 TDP1 (0.47) TDP1L3MBTL1DRD2DRD4NPC1
SCHEMBL28606854 0.72 CTBP2 (0.49) TDP1L3MBTL1ALDH1A1KDM4ERXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1119824-A Fungicidal mixture BASF AG (DE) 1996-04-03 CN disclosed