SCHEMBL26669751

SCHEMBL26669751

CCc1cc2c(cc1CF)CCC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 0.34
HSD17B1 P14061 1/20 0.33
P2RX7 Q99572 2/20 0.33
GNG2 P59768 1/20 0.33
GNB1 P62873 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KMT2A Q03164 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CDC25B P30305 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7175506 0.89 GRIN2D (0.41) NPC1RAB9AGRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL866128 0.84 NPC1 (0.39) NPC1RAB9AGRIN2DGRIN3BGRIN1
SCHEMBL13092307 0.78 P2RX7 (0.38) NPC1RAB9AGRIN2DGRIN3BGRIN1
SCHEMBL10158645 0.74 GRIN2D (0.42) NPC1RAB9AGRIN2DGRIN3BGRIN1
SCHEMBL11492053 0.72 TAAR1 (0.34) NPC1RAB9AGRIN2DGRIN3BGRIN1
SCHEMBL13332559 0.71 HSD17B1 (0.51) HSD17B1P2RX7ALDH1A1KMT2AMEN1
SCHEMBL11810833 0.71 MEN1 (0.52) HSD17B1KMT2ANPSR1MEN1
Benzylamine SCHEMBL15270988 0.70 LOXL2 (0.48) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL10290603 0.70 MAPT (0.48) NPC1RAB9AHSD17B1GNG2GNB1
SCHEMBL11984545 0.69 AR (0.33) NPC1RAB9AP2RX7GNG2GNB1

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-4269415-A1 TETRAHYDRO THIENOPYRIDINE SULFONAMIDE COMPOUND Modulus Discovery, Inc. (JP) 2023-11-01 EP disclosed