SCHEMBL8923227

SCHEMBL8923227

CCN(C(=O)n1nnn(-c2ccncc2Cl)c1=O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
TSHR P16473 1/20 0.32
P2RX4 Q99571 1/20 0.32
BCL2A1 Q16548 1/20 0.32
LMNA P02545 1/20 0.30

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
SCHEMBL8923229 1.00 HCAR1 (0.33) HCAR1FNTAFNTBTSHRP2RX4
SCHEMBL8464528 0.75 KMT2A (0.39) TSHRLMNA
SCHEMBL8464531 0.75 KMT2A (0.39) TSHRLMNA
SCHEMBL8464656 0.71 P2RX4 (0.48) P2RX4LMNA
SCHEMBL8464658 0.71 P2RX4 (0.48) P2RX4LMNA
SCHEMBL8307255 0.70 NOTUM (0.43) TSHRLMNA
SCHEMBL12115975 0.70 PDE4B (0.40) P2RX4
SCHEMBL9017372 0.70 P2RX1 (0.38) TSHRP2RX4
SCHEMBL9017368 0.70 P2RX1 (0.38) TSHRP2RX4
SCHEMBL12115988 0.69 P2RX4 (0.48) P2RX4LMNA

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-5641727-A Herbicidal 1-pyridyltetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1997-06-24 US claimed