SCHEMBL25440347

SCHEMBL25440347

CCc1nc(-c2ccccc2F)co1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.44
ADORA2A P29274 4/20 0.41
ADORA1 P30542 4/20 0.41
ADORA3 P0DMS8 3/20 0.41
ADORA2B P29275 1/20 0.41
NPC1 O15118 1/20 0.40
MPL P40238 1/20 0.40
TLR8 Q9NR97 1/20 0.39
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38
TUBA1A Q71U36 1/20 0.38
TUBA1C Q9BQE3 1/20 0.38

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
SCHEMBL10790264 0.79 ENPP1 (0.50) NPC1TLR8KDM4EALDH1A1S1PR1
SCHEMBL20385737 0.77 ENPP3 (0.51) NPC1MPLNOTUMIDO1MEN1
SCHEMBL9880273 0.75 S1PR1 (0.50) S1PR1MEN1KMT2A
SCHEMBL6203016 0.75 CNR2 (0.42) CNR2ADORA2AADORA1ADORA3ADORA2B
SCHEMBL20242216 0.74 MPL (0.51) ADORA2ANPC1MPLTLR8KDM4E
SCHEMBL14637421 0.74 MPL (0.47) NPC1MPLALDH1A1PARP1NOTUM
SCHEMBL20389346 0.74 NPC1 (0.43) NPC1MPLKDM4EALDH1A1PARP1
SCHEMBL20385746 0.73 NPC1 (0.40) ADORA2AADORA1ADORA3ADORA2BNPC1
SCHEMBL25440366 0.73 NPC1 (0.40) ADORA2AADORA1ADORA3ADORA2BNPC1
SCHEMBL20286125 0.73 NPC1 (0.40) ADORA2AADORA1ADORA3ADORA2BNPC1

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-3555100-B1 BENZODIAZEPINE DERIVATIVES, COMPOSITIONS, AND METHODS FOR TREATING COGNITIVE IMPAIRMENT AGENEBIO INC (US) 2023-05-10 EP disclosed