SCHEMBL27993602

SCHEMBL27993602

CCCCCCCCCCC(N)CNC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.61
PRSS1 P07477 2/20 0.50
CTSG P08311 2/20 0.50
CTRB1 P17538 2/20 0.50
CMA1 P23946 2/20 0.50
HDAC3 O15379 4/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.45
FOLH1 Q04609 2/20 0.44
TP53 P04637 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL28472074 0.99 NAAA (0.59) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL28181763 0.88 NPC1 (0.53) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL27619620 0.87 NAAA (0.73) NAAAHDAC3NPC1RAB9ASMN1; SMN2
SCHEMBL27406375 0.87 NAAA (0.68) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL27406374 0.87 NAAA (0.68) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL27700892 0.85 NAAA (0.65) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL27391971 0.84 NAAA (0.63) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL1769658 0.82 NPC1 (0.50) PRSS1CTSGCTRB1CMA1HDAC3
SCHEMBL27687297 0.82 NAAA (0.68) NAAAPRSS1CTSGCTRB1CMA1
SCHEMBL27687320 0.82 NAAA (0.68) NAAAPRSS1CTSGCTRB1CMA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276203-A Method for synthesizing 2-aminobenzamide compound by ultraviolet light induction 湖南大学 2022-04-05 CN disclosed
CN-104204136-A Indolo [2,1-a ] quinazoline derivatives for stabilizing organic materials BASF SE 2014-12-10 CN disclosed