SCHEMBL6287767

SCHEMBL6287767

CCSc1ncccc1C=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.47
TRIM33 Q9UPN9 1/20 0.47
ALDH1A1 P00352 8/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
KDM4E B2RXH2 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
THRB P10828 1/20 0.37
BLM P54132 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HSP90AA1 P07900 1/20 0.37
IDO1 P14902 1/20 0.37
HPGD P15428 2/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL9502601 0.81 GPR84 (0.43) TRIM24TRIM33ALDH1A1NPSR1MAPT
SCHEMBL1255150 0.79 TRIM24 (0.52) TRIM24TRIM33ALDH1A1KDM4ENPC1
SCHEMBL7524895 0.79 CYP1A2 (0.45) TRIM24TRIM33ALDH1A1SMN1; SMN2KDM4E
SCHEMBL9250621 0.78 ALDH1A1 (0.59) TRIM24TRIM33ALDH1A1SMN1; SMN2NPC1
SCHEMBL16152755 0.77 KDR (0.47) TRIM24TRIM33ALDH1A1SMN1; SMN2KMT2A
SCHEMBL805428 0.76 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL1584131 0.75 TRIM24 (0.47) TRIM24TRIM33ALDH1A1KDM4ENPC1
SCHEMBL12048608 0.73 KDM4E (0.45) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL16334247 0.73 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL10834448 0.73 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2KDM4ENPC1LMNA

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
WO-2021032033-A1 PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2021-02-25 WO disclosed
US-6951918-B2 Peptidic procollagen C-proteinase inhibitors SYNTEX (U.S.A.) LLC (US) 2005-10-04 US disclosed
US-6426402-B1 RESPIRATORY SYSTEM DISORDERS; RHEUMATIC DISEASES SYNTEX (U.S.A.) LLC 2002-07-30 US disclosed