SCHEMBL10928632

SCHEMBL10928632

NN(c1ccccc1)C1CCSC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
DRD4 P21917 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8518648 0.78 TAAR1 (0.36) ALDH1A1
SCHEMBL3485394 0.74 KDM4E (0.43) ALDH1A1
SCHEMBL18639248 0.72 KDM4E (0.46) ALDH1A1
SCHEMBL5971405 0.72 KDM4E (0.46) ALDH1A1
Hydrochloric Acid SCHEMBL9391758 0.71 KDM4E (0.45) ALDH1A1
Hydrochloric Acid SCHEMBL7818342 0.71 KDM4E (0.45) ALDH1A1
SCHEMBL22634123 0.69 SLC18A3 (0.45)
SCHEMBL8534401 0.67 CHRM1 (0.49) TSHRMAPK1
SCHEMBL22187019 0.66 CHRM3 (0.37) ALDH1A1DRD4
SCHEMBL22074356 0.66 TRPM8 (0.67) ALDH1A1

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
US-4531963-A Promoting germination of oil seeds THE UPJOHN COMPANY (US) 1985-07-30 US claimed
US-4531963-A Promoting germination of oil seeds THE UPJOHN COMPANY (US) 1985-07-30 US disclosed