SCHEMBL8020852

SCHEMBL8020852

Cc1ncccc1C(O)C#N

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39

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
SCHEMBL17682018 0.81 P2RX7 (0.35)
SCHEMBL17681988 0.81 P2RX7 (0.35)
SCHEMBL11072786 0.78 P2RX7 (0.40)
SCHEMBL23886707 0.78
SCHEMBL24113945 0.76 P2RX7 (0.39) TSHR
SCHEMBL5698980 0.76 P2RX7 (0.39) TSHR
SCHEMBL23489779 0.76 P2RX7 (0.39) TSHR
SCHEMBL15927758 0.76 P2RX7 (0.39) TSHR
SCHEMBL1578784 0.74 KDM4E (0.44) TSHR
Hydrochloric Acid SCHEMBL27815688 0.73 KDM4E (0.42) TSHR

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-6043197-A PESTICIDES, FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-28 US disclosed