SCHEMBL8629939

SCHEMBL8629939

Cc1cc(F)ccc1-c1c(-c2ccccc2S(N)(=O)=O)n[nH]c1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
ALDH1A1 P00352 3/20 0.43
LMNA P02545 1/20 0.43
GPR55 Q9Y2T6 3/20 0.42
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NR2F2 P24468 1/20 0.42
GYS1 P13807 4/20 0.42
ABCC8 Q09428 1/20 0.39
KCNJ11 Q14654 1/20 0.39
LRRK2 Q5S007 3/20 0.39
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
PLA2G1B P04054 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL8633926 0.90 MAPT (0.46) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL8630119 0.89 MAPT (0.45) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL8630534 0.87 MAPT (0.60) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL8631356 0.83 GYS1 (0.57) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL8634944 0.83 LRRK2 (0.49) MAPTLMNAGPR55CNR1CNR2
SCHEMBL8627701 0.82 GYS1 (0.46) MAPTGPR55CNR1CNR2MEN1
SCHEMBL8634599 0.82 LRRK2 (0.46) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL7777717 0.82 MAP2K7 (0.53) GYS1ABCC8KCNJ11LRRK2
SCHEMBL8629857 0.80 LRRK2 (0.48) MAPTALDH1A1LMNAGPR55CNR1
SCHEMBL8635288 0.80 MAPT (0.42) MAPTALDH1A1LMNAGPR55CNR1

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-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed