SCHEMBL10558366

SCHEMBL10558366

Cc1ccc2c(c1)C1=NN(c3ccc(Cl)cc3)C(=O)CC1C[S+]2[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
AGTR1 P30556 1/20 0.37
KDM4E B2RXH2 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GRM5 P41594 2/20 0.35
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33

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
SCHEMBL10560151 0.92 MAPT (0.39) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10561445 0.88 GRM5 (0.37) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10558285 0.88 GABRP (0.42) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10558290 0.88 GABRP (0.42) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10560746 0.87 GRM5 (0.35) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL7297596 0.81 MAPT (0.38) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL7288991 0.78 GABRP (0.40) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10564163 0.78 CA12 (0.35) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL9191920 0.78 GRM5 (0.36) MAPTKMT2AHTTMEN1ALDH1A1
SCHEMBL10367467 0.78 MAPT (0.44) MAPTKMT2AHTTMEN1ALDH1A1

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
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 US claimed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 EP claimed
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 US disclosed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 EP disclosed