SCHEMBL16634665

SCHEMBL16634665

O=C(c1c(Cl)cccc1Cl)n1c(=O)n(-c2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.39
PARG Q86W56 2/20 0.39
LMNA P02545 4/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
PIK3CG P48736 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
CACNA1B Q00975 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
SCHEMBL16634721 0.82 RAB9A (0.45) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL16634554 0.76 RORC (0.55) L3MBTL1
SCHEMBL16634830 0.75 RORC (0.43) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16634709 0.74 TAS1R3 (0.44)
SCHEMBL16634740 0.74 RORC (0.37) ALDH1A1TSHRKDM4ESMN1; SMN2MAPT
SCHEMBL16634643 0.74 RORC (0.40)
SCHEMBL16634644 0.72 RORC (0.40) ALDH1A1GAATSHRL3MBTL1SMN1; SMN2
SCHEMBL16634666 0.71 MYC (0.48) ALDH1A1MEN1KMT2ATSHRL3MBTL1
SCHEMBL16634717 0.69 RORC (0.55)
SCHEMBL16634602 0.69 PARG (0.50) ALDH1A1MEN1KMT2AHTTPARG

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
WO-2015052675-A1 SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-04-16 WO claimed
WO-2015052675-A1 SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-04-16 WO disclosed