SCHEMBL22306207

SCHEMBL22306207

Cn1ccc(C(=O)NCC(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 12/20 0.65
▸ NPC1 O15118 11/20 0.65
▸ SMN1; SMN2 Q16637 11/20 0.65
▸ MAPT P10636 10/20 0.65
▸ LMNA P02545 8/20 0.65
▸ ALDH1A1 P00352 6/20 0.65
▸ NFKB1 P19838 3/20 0.65
▸ NFKB2 Q00653 3/20 0.65
▸ RELA Q04206 3/20 0.65
▸ KMT2A Q03164 10/20 0.63
▸ MEN1 O00255 9/20 0.63
▸ GAA P10253 1/20 0.63
▸ KDM4E B2RXH2 4/20 0.62
▸ CLK1 P49759 2/20 0.62
▸ POLB P06746 2/20 0.54
▸ HTT P42858 1/20 0.53
▸ TSHR P16473 2/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ GSTO1 P78417 1/20 0.48

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
SCHEMBL22306344 0.90 RAB9A (0.52) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22306193 0.85 RAB9A (0.46) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL21241927 0.84 RAB9A (0.66) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22306617 0.84 RAB9A (0.44) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22305951 0.83 MAPT (0.55) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22305368 0.83 MAPT (0.49) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22305784 0.81 RAB9A (0.43) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL22306345 0.81 ROCK2 (0.47) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL22290647 0.81 PARP1 (0.47) MAPTALDH1A1
SCHEMBL22305714 0.81 WNT3A (0.45) MAPTKMT2AMEN1MAPK1

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-2020160180-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 — — WO disclosed
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