SCHEMBL11795447

SCHEMBL11795447

OCC1CSC(c2ccccc2O)S1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ACE P12821 2/20 0.36
HTR2B P41595 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL5213356 0.90 ALDH1A1 (0.30) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL28748700 0.81 ALDH1A1 (0.35) ALDH1A1
SCHEMBL5205512 0.81 HTR1A (0.36) MEN1KMT2AMAPTNPSR1HTR2C
SCHEMBL5207532 0.80 HTR2C (0.30) HTR2BHTR2C
SCHEMBL6862831 0.80 KDM1A (0.39) MAPT
SCHEMBL6862816 0.77 SLC18A3 (0.34) ALDH1A1
SCHEMBL5212503 0.74 GABRP (0.37) ALDH1A1
SCHEMBL11792377 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL6864202 0.72 KDM1A (0.36)
SCHEMBL6606477 0.72

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-3944674-A Combating insects with o dimethoxymethylphenyl-N-methylcarbamate CIBA-GEIGY AG (CH) 1976-03-16 US disclosed