SCHEMBL22305371

SCHEMBL22305371

CC(C)(C)n1ccc(C(=O)NCC(=O)NC2=NC(c3cccc(N4CCOCC4)c3)=CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KDM1A O60341 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ CSNK1D P48730 1/20 0.38
▸ STK17B O94768 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ PLOD2 O00469 2/20 0.35
▸ PLOD3 O60568 2/20 0.35
▸ PLOD1 Q02809 2/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ HSP90AB1 P08238 1/20 0.35
▸ JMJD6 Q6NYC1 1/20 0.35
▸ JAK3 P52333 3/20 0.35
▸ JAK1 P23458 2/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ ATR Q13535 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ KIF18A Q8NI77 1/20 0.34

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
SCHEMBL22306478 0.84 POLB (0.34) SMN1; SMN2L3MBTL1
SCHEMBL22290358 0.81 PHGDH (0.48) SMN1; SMN2KDM1AHDAC1CSNK1D
SCHEMBL31173227 0.81 PHGDH (0.48) SMN1; SMN2KDM1AHDAC1CSNK1D
SCHEMBL22306735 0.80 USP2 (0.33) SMN1; SMN2L3MBTL1KDM1AHDAC1CSNK1D
SCHEMBL22305518 0.80 ADORA2A (0.32) —
SCHEMBL22305520 0.80 ADORA2A (0.32) —
SCHEMBL22306196 0.79 CCR2 (0.34) SMN1; SMN2
SCHEMBL22306616 0.79 L3MBTL1 (0.32) SMN1; SMN2L3MBTL1KDM1AHDAC1NAMPT
SCHEMBL22306597 0.76 — —
SCHEMBL22305377 0.76 HTR1A (0.33) —

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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