SCHEMBL11073608

SCHEMBL11073608

COc1cc[n+](C)c2ccccc12.Cc1ccc(S(=O)(=O)[O-])c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAD52 P43351 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAP1LC3B Q9GZQ8 1/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 3/20 0.35
F2 P00734 1/20 0.35
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
GFER P55789 1/20 0.34
RAB9A P51151 1/20 0.34
RCE1 Q9Y256 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
SCHEMBL6334665 0.76 RAB9A (0.47) SMN1; SMN2PKMMAPK1HTTRAD52
SCHEMBL6745098 0.71 RAB9A (0.44) SMN1; SMN2PKMMAPK1HTTRAD52
SCHEMBL6745095 0.71 RAB9A (0.46) SMN1; SMN2PKMMAPK1HTTRAD52
SCHEMBL1002271 0.71 KDM4E (0.42) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL6332742 0.70 RAB9A (0.43) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL6915073 0.70 SMN1; SMN2 (0.47) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL6918125 0.70 LMNA (0.47) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL6916390 0.70 SMN1; SMN2 (0.47) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL6917233 0.70 LMNA (0.47) LMNASMN1; SMN2PKMMAPK1HTT
SCHEMBL360361 0.70 LMNA (0.47) LMNASMN1; SMN2PKMMAPK1HTT

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
US-4431774-A QUINOLINIUM SULFONATES AS LATENT ACID CATALYSTS; RADIATION; DECOMPOSITION; STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1984-02-14 US disclosed