SCHEMBL28759152

SCHEMBL28759152

c1ccc(Cc2csc(Cc3ccccc3)n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.59
HDAC6 Q9UBN7 5/20 0.59
HDAC8 Q9BY41 1/20 0.53
RAB9A P51151 4/20 0.46
ALDH1A1 P00352 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
NOS1 P29475 1/20 0.44
C1S P09871 1/20 0.44
CALM1 P0DP23 1/20 0.42
LTA4H P09960 1/20 0.42
MAPT P10636 1/20 0.42
ECE1 P42892 1/20 0.42
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL5656467 0.87 HDAC1 (0.55) HDAC1HDAC6HDAC8RAB9AALDH1A1
SCHEMBL2705651 0.87 HDAC1 (0.48) HDAC1HDAC6HDAC8RAB9AALDH1A1
SCHEMBL5659797 0.87 HDAC1 (0.55) HDAC1HDAC6HDAC8RAB9AALDH1A1
SCHEMBL14493945 0.87 HDAC1 (0.48) HDAC1HDAC6HDAC8ALDH1A1CDK5
SCHEMBL10918996 0.87 HDAC1 (0.58) HDAC1HDAC6HDAC8RAB9AALDH1A1
SCHEMBL1809552 0.85 HDAC1 (0.51) HDAC1HDAC6HDAC8NOS1C1S
SCHEMBL8222179 0.84 LOXL2 (0.57) HDAC1HDAC6HDAC8SMN1; SMN2NOS1
SCHEMBL26986062 0.83 HDAC1 (0.62) HDAC1HDAC6HDAC8RAB9AALDH1A1
SCHEMBL27923748 0.81 HDAC1 (0.47) HDAC1HDAC6RAB9AALDH1A1L3MBTL1
SCHEMBL13680923 0.80 HDAC1 (0.59) HDAC1HDAC6HDAC8RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114341414-B flame retardant fabric 美利肯公司 2024-02-13 CN disclosed
CN-219321988-U Blowable flexible inner catheter and catheter system 美利肯公司 2023-07-07 CN disclosed
CN-116247580-A Blowable flexible inner catheter 美利肯公司 2023-06-09 CN disclosed
CN-1805945-A Biaryl substituted thiazoles, oxazoles and imidazoles as sodium channel blockers MERCK & CO INC (US) 2006-07-19 CN disclosed