SCHEMBL9004465

SCHEMBL9004465

Cc1ccc2c(c1)Nc1ccccc1[S+]2[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1G1 Q9HCP0 1/20 0.42
CDK5 Q00535 2/20 0.41
ROS1 P08922 1/20 0.41
ACVR1 Q04771 1/20 0.41
LRRK2 Q5S007 1/20 0.41
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
CYP2A6 P11509 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31

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
SCHEMBL29610326 0.82 GAA (0.40) ACVR1LRRK2RAB9ASMN1; SMN2NPC1
SCHEMBL342511 0.82 GAA (0.40) ACVR1LRRK2RAB9ASMN1; SMN2NPC1
SCHEMBL30771770 0.80 GAA (0.39) ACVR1LRRK2TDP1KDM4EGAA
SCHEMBL31362086 0.79 BCHE (0.46) CDK5SMN1; SMN2TDP1MEN1MAPT
SCHEMBL11369902 0.79 BCHE (0.46) CDK5SMN1; SMN2TDP1MEN1MAPT
SCHEMBL20551035 0.78 NOX1 (0.50) CDK5RAB9ASMN1; SMN2NPC1TDP1
SCHEMBL31614597 0.73 GAA (0.43) CDK5SMN1; SMN2TDP1KDM4EALDH1A1
SCHEMBL16270632 0.72 CSNK1G1 (0.69) CSNK1G1CDK5ROS1ACVR1LRRK2
SCHEMBL15502223 0.71 CHEK1 (0.42) CDK5LRRK2SMN1; SMN2TDP1ALDH1A1
SCHEMBL13833024 0.71 MAPT (0.33) CDK5LRRK2RAB9ASMN1; SMN2NPC1

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
US-5500760-A Electrochemichromic solutions, processes for preparing and using the same, and devices manufactured with the same DONNELLY CORPORATION (US) 1996-03-19 US disclosed
EP-0531143-A2 Electrochemichromic solutions, processes for preparing and using the same, and devices manufactured with the same DONNELLY CORPORATION (US) 1993-03-10 EP disclosed