SCHEMBL6423679

SCHEMBL6423679

CC(=O)n1c(C)c(O)c2c(Cl)c(F)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
AKR1B1 P15121 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
POLB P06746 1/20 0.32
ELANE P08246 1/20 0.31
AKR1C3 P42330 2/20 0.31
AKR1C2 P52895 2/20 0.31
PTGDR Q13258 2/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL27636566 0.84 PTGDR2 (0.34) PTGDR2AKR1B1TSHRHTR2AHTR2C
SCHEMBL6420797 0.79 KDM4E (0.32) MAPTKMT2AKDM4ENPC1RAB9A
SCHEMBL6421179 0.79 ACLY (0.38) MAPTKMT2AKDM4ENPC1RAB9A
SCHEMBL3564119 0.72 NOTUM (0.41) NOTUMMAPTKMT2AKDM4ENPC1
SCHEMBL3556800 0.69 AKR1C3 (0.42) PTGDR2POLBAKR1C3AKR1C2PTGDR
SCHEMBL3556523 0.69 GAA (0.44) PTGDR2MAPTKMT2AAKR1B1KDM4E
SCHEMBL27363222 0.65 NOTUM (0.37) NOTUMMAPTKMT2AKDM4ENPC1
SCHEMBL8959947 0.65 NOTUM (0.37) NOTUMMAPTKMT2AKDM4ENPC1
SCHEMBL14280273 0.65 KCNJ1 (0.32) POLB
SCHEMBL8959872 0.64 CYP4F2 (0.38) NOTUMMAPTKMT2AKDM4ENPC1

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
EP-1567492-B1 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LTD (IN) 2013-05-22 EP disclosed
EP-1567492-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES Suven Life Sciences Limited (IN) 2005-08-31 EP disclosed
WO-2004048328-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed
WO-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed