SCHEMBL7808250

SCHEMBL7808250

CCOCCN1C2CCC1CC(=O)C2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
OPRM1 P35372 2/20 0.35
OPRD1 P41143 2/20 0.35
CYP2C19 P33261 3/20 0.33
CYP2D6 P10635 2/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP3A4 P08684 2/20 0.30
MAPT P10636 1/20 0.30
FKBP1A P62942 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL7804700 0.81 MAPK1 (0.44) MAPK1MEN1KMT2AOPRM1OPRD1
SCHEMBL5415021 0.79 MAPK1 (0.48) MAPK1MEN1KMT2AOPRM1OPRD1
SCHEMBL5071115 0.78 MAPK1 (0.46) MAPK1MEN1KMT2A
SCHEMBL7809891 0.78 LMNA (0.33) OPRM1OPRD1CYP2C19CYP2D6LMNA
SCHEMBL7805795 0.76 LMNA (0.38) CYP2C19CYP2D6LMNA
SCHEMBL7805796 0.76 LMNA (0.38) CYP2C19CYP2D6LMNA
SCHEMBL26157415 0.74 LMNA (0.39) MEN1KMT2ACYP2C19CYP2D6LMNA
SCHEMBL8505608 0.74 MAPK1 (0.36) MAPK1MEN1KMT2AHSD17B10CYP3A4
SCHEMBL7808304 0.71 ACHE (0.44) MAPK1MEN1KMT2AOPRM1OPRD1
SCHEMBL3645840 0.69 GSK3A (0.45) MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710662-B1 QUINOLINECARBOXYLIC ACID DERIVATIVE SYNGENTA LTD (GB) 2001-04-04 EP disclosed
EP-1018513-A2 Quinolinecarboxylic acid derivatives ZENECA LIMITED (GB) 2000-07-12 EP disclosed
EP-0710662-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1996-05-08 EP disclosed