SCHEMBL22968334

SCHEMBL22968334

CC(C)N(C(C)C)P(OCCC#N)OCCCCCC(=O)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ATM Q13315 1/20 0.38
HPGD P15428 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32

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
SCHEMBL1501122 0.82 ALDH1A1 (0.39) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL16328978 0.82
SCHEMBL5597403 0.82 ALDH1A1 (0.39) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL13675273 0.80
SCHEMBL23735636 0.80 SPHK1 (0.37)
SCHEMBL23735610 0.80 SPHK1 (0.37)
SCHEMBL23735587 0.80 SPHK1 (0.37)
SCHEMBL9152252 0.80 TSHR (0.35) L3MBTL1KMT2ALMNAALDH1A1TSHR
SCHEMBL13073086 0.79 MCL1 (0.32)
SCHEMBL23735628 0.79 SPHK1 (0.38)

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-3862431-B1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES TORAY INDUSTRIES (JP) 2024-06-26 EP disclosed
EP-3862431-A1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES Toray Industries, Inc. (JP) 2021-08-11 EP disclosed
WO-2021024467-A1 PRODUCTION METHOD FOR SINGLE-STRAND RNA 住友化学株式会社 2021-02-11 WO disclosed