SCHEMBL10517641

SCHEMBL10517641

CNCC1(O)c2ccccc2CSc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.39
CCR1 P32246 6/20 0.39
HSD17B3 P37058 2/20 0.38
CYP2D6 P10635 5/20 0.35
SLC6A2 P23975 5/20 0.35
SLC6A4 P31645 5/20 0.35
SLC6A3 Q01959 4/20 0.34
KIF11 P52732 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL10517183 0.87 LMNA (0.41) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10518376 0.86 HSD17B3 (0.44) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10518982 0.86 LMNA (0.38) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10519242 0.84 LMNA (0.39) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10519086 0.83 LMNA (0.36) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10518197 0.80 SLC6A4 (0.38) LMNAHTTNPSR1HSD17B3CYP2D6
SCHEMBL10521688 0.72 LMNA (0.36) LMNACCR1HSD17B3CYP2D6SLC6A2
SCHEMBL13379763 0.71 LMNA (0.48) LMNAHTTNPSR1SMN1; SMN2CCR1
SCHEMBL10728041 0.71 LMNA (0.37) LMNAHTTNPSR1CCR1HSD17B3
SCHEMBL10723665 0.70 LMNA (0.34) LMNAHTTNPSR1CCR1HSD17B3

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-0189078-B1 TRICYCLIC COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND METHOD OF TREATMENT THEREWITH AB LEO (SE) 1989-06-28 EP disclosed
US-4645758-A Urinary incontinence ameliorating dibenz- b,e- -oxepin and -thiepin derivatives, compositions, and method of use therefor AKTIEBOLAGET LEO (SE) 1987-02-24 US disclosed
EP-0189078-A1 Tricyclic compounds, compositions containing such compounds, processes for their preparation and method of treatment therewith AB LEO (SE) 1986-07-30 EP disclosed