SCHEMBL7765809

SCHEMBL7765809

C=C1CC(CSCc2ccccc2)N(Cc2ccccc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.42
ALDH1A1 P00352 6/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CRBN Q96SW2 1/20 0.39
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
MEN1 O00255 2/20 0.36
PSMD14 O00487 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
TSHR P16473 3/20 0.34
HPGD P15428 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 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
SCHEMBL7764955 0.85 EHMT2 (0.38) EHMT2ALDH1A1LMNAKMT2AHTT
SCHEMBL7766697 0.84 EHMT2 (0.38) EHMT2ALDH1A1LMNAKMT2AHTT
SCHEMBL7769361 0.79 CYP1A2 (0.40) EHMT2ALDH1A1KMT2AGAAMEN1
SCHEMBL7764994 0.78 ALDH1A1 (0.38) ALDH1A1LMNAKMT2AHTTSMN1; SMN2
SCHEMBL7765772 0.76 SDCBP (0.38) EHMT2ALDH1A1KMT2AMAPTMEN1
SCHEMBL7762178 0.74 CRBN (0.46) EHMT2ALDH1A1LMNAKMT2AHTT
SCHEMBL7761783 0.74 LMNA (0.46) EHMT2ALDH1A1LMNAKMT2AMEN1
SCHEMBL7766819 0.73 MEN1 (0.36) EHMT2ALDH1A1KMT2AMAPTMEN1
SCHEMBL7765797 0.71 KMT2A (0.38) EHMT2ALDH1A1KMT2AGAAMEN1
SCHEMBL7766815 0.70 CRBN (0.43) ALDH1A1LMNAKMT2AHTTSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0639566-B1 CYCLIC COMPOUND SANTEN PHARMACEUTICAL CO LTD (JP) 2001-06-20 EP disclosed
US-5461158-A Immunodeficiency and autoimmune diseases SANTEN PHARMACEUTICAL CO., LTD. (JP) 1995-10-24 US disclosed
EP-0639566-A1 CYCLIC COMPOUND SANTEN PHARMACEUTICAL CO., LTD. (JP) 1995-02-22 EP disclosed