SCHEMBL8817554

SCHEMBL8817554

Clc1ccc(Cc2nc3c(Cc4ccc(Cl)cc4)cccc3[nH]2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRNP P04156 1/20 0.56
MAPT P10636 1/20 0.56
GRIN1 Q05586 2/20 0.48
GRIN2B Q13224 2/20 0.48
GAA P10253 3/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
HTR6 P50406 3/20 0.44
RHEB Q15382 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
SCHEMBL9015054 0.90 PRNP (0.46) PRNPMAPTGRIN1GRIN2BGAA
SCHEMBL11198298 0.87 MGAM (0.48) PRNPMAPTGAAMGAMSI
SCHEMBL456478 0.83 HTT (0.49) PRNPMAPTGRIN2BALDH1A1HTR6
SCHEMBL9015051 0.80 RAB9A (0.43) PRNPMAPTGRIN1GRIN2BGAA
SCHEMBL162159 0.80 LTA4H (0.41) PRNPMAPTHTR6
SCHEMBL10690713 0.79 GAA (0.47) GRIN1GRIN2BGAANPC1ALDH1A1
SCHEMBL8816632 0.78 MGAM (0.56) GRIN2BGAAMGAMSIMGAM2
SCHEMBL6686102 0.77 MGAM (0.62) MAPTGRIN2BGAAMGAMSI
SCHEMBL721860 0.76 GAA (0.75) PRNPMAPTGRIN1GRIN2BGAA
SCHEMBL9307952 0.75 NPC1 (0.46) GRIN1GRIN2BGAAMGAMSI

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
WO-1997031635-A1 METHODS OF TREATING OR PREVENTING SLEEP APNEA ELI LILLY AND COMPANY (US) 1997-09-04 WO disclosed