SCHEMBL7438240

SCHEMBL7438240

CC(C(N)=S)c1ncc[nH]1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
CSNK1A1 P48729 1/20 0.37
TYRO3 Q06418 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
FPR2 P25090 5/20 0.36
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
F2RL1 P55085 6/20 0.35
MMP1 P03956 1/20 0.34
MMP3 P08254 1/20 0.34
MMP7 P09237 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
SCHEMBL5460567 0.81 CSNK1A1 (0.44) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL29046781 0.77 ADRA2A (0.53) ADRA2AADRA2BADRA2CFPR2ALDH1A1
SCHEMBL27693248 0.76 FPR2 (0.44) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL6448258 0.74 FPR2 (0.43) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL570524 0.74 ADRA2A (0.47) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL28626525 0.74 FPR2 (0.43) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
Bromide SCHEMBL28219788 0.73 ADRA2A (0.46) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
Hydrochloric Acid SCHEMBL28220351 0.73 ADRA2A (0.46) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL4411652 0.73 MMP1 (0.43) ADRA2AADRA2BADRA2CCSNK1A1TYRO3
SCHEMBL23863035 0.73

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
EP-0397365-B1 Arylthiazolylimidazoles as 5HT3 Antagonists PFIZER (US) 1994-03-02 EP disclosed
US-4914207-A ANTIEMETICS PFIZER INC. (US) 1990-04-03 US disclosed