SCHEMBL28986970

SCHEMBL28986970

CNC(CC(=O)O)C(=O)C1=NNc2ccccc2C=C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
P2RX4 Q99571 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
SCHEMBL1226277 0.74 MAPT (0.42) ALDH1A1MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL2979173 0.72 MAPT (0.41) ALDH1A1MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL4915107 0.72 GAA (0.37) ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL27427681 0.72 SMN1; SMN2 (0.42) ALDH1A1MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL27600468 0.72 MAPT (0.37) MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL2930324 0.70 MAPT (0.38) MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL7026732 0.70 MAPT (0.41) MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL4058588 0.70 MAPT (0.41) MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL15865155 0.69 MAPT (0.37) MAPTRAB9ASMN1; SMN2P2RX4
SCHEMBL27734431 0.69 GAA (0.44) ALDH1A1MAPTRAB9ASMN1; SMN2

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
CN-115997853-A High-protein feed and processing method thereof 唐小强 2023-04-25 CN disclosed