SCHEMBL14146507

SCHEMBL14146507

CCc1ncc(CCC(=O)O)o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 8/20 0.44
▸ RXRB P28702 8/20 0.44
▸ RXRG P48443 6/20 0.44
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ DDAH1 O94760 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ PKM P14618 4/20 0.39
▸ HTT P42858 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HPGD P15428 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ ABCC4 O15439 1/20 0.39
▸ C5 P01031 1/20 0.39
▸ LMNA P02545 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
SCHEMBL18359190 0.82 GAA (0.42) RXRARXRBRXRGKDM4EHSD17B10
SCHEMBL8532973 0.79 ALDH1A1 (0.45) RXRARXRBRXRGALDH1A1KDM4E
SCHEMBL4632525 0.71 RXRA (0.54) RXRARXRBRXRGALDH1A1KDM4E
SCHEMBL6480225 0.71 ALDH1A1 (0.56) ALDH1A1KDM4ECYP2C19DDAH1CYP1A2
SCHEMBL1912604 0.71 NPC1 (0.40) ALDH1A1KDM4ECYP1A2SMN1; SMN2MAPT
SCHEMBL8532736 0.70 LMNA (0.49) KDM4EPOLBHPGDTSHRLMNA
SCHEMBL2040301 0.70 — —
SCHEMBL20275214 0.69 RXRA (0.45) RXRARXRBRXRGKDM4ECYP2C19
SCHEMBL24082692 0.69 PPARA (0.60) ALDH1A1SMN1; SMN2POLBTDP1HPGD
SCHEMBL13851669 0.69 HDAC1 (0.40) RXRARXRBRXRGSMN1; SMN2HSD17B10

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
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 — — EP disclosed
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