SCHEMBL27412265

SCHEMBL27412265

CN1CCN(C(=O)Cc2csc(NC(=O)Nc3ccc(OCc4cn(C)nn4)cc3)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 3/20 0.46
▸ F10 P00742 3/20 0.46
▸ MAPT P10636 5/20 0.43
▸ HSD11B1 P28845 2/20 0.42
▸ HSD17B1 P14061 1/20 0.42
▸ HSD17B2 P37059 1/20 0.42
▸ LMNA P02545 4/20 0.42
▸ TP53 P04637 1/20 0.42
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ HTT P42858 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 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
SCHEMBL27412307 0.87 HSD11B1 (0.44) F2F10MAPTHSD11B1HSD17B1
SCHEMBL27412237 0.84 MAPT (0.52) F2F10MAPTHSD11B1HSD17B1
SCHEMBL30932945 0.83 HSD11B1 (0.47) F2F10MAPTHSD11B1HSD17B1
SCHEMBL30932939 0.79 HSD11B1 (0.43) F2F10MAPTHSD11B1HSD17B1
SCHEMBL30932940 0.79 HSD11B1 (0.43) F2F10MAPTHSD11B1HSD17B1
SCHEMBL9986293 0.74 F2 (0.50) F2F10MAPTHSD11B1HSD17B1
SCHEMBL27411959 0.74 SIRT2 (0.39) MAPTLMNATP53NPC1RAB9A
Hydrochloric Acid SCHEMBL9987587 0.73 F2 (0.49) F2F10MAPTHSD11B1HSD17B1
SCHEMBL17925445 0.71 LMNA (0.53) F2F10MAPTHSD11B1HSD17B1
SCHEMBL30932919 0.69 HSD11B1 (0.52) F2F10HSD11B1HSD17B1HSD17B2

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-2024112918-A1 RNA DEGRADERS AND USES THEREOF ARRAKIS THERAPEUTICS, INC. (US) 2024-05-30 — — WO disclosed
Send feedback