SCHEMBL7642307

SCHEMBL7642307

CCCOc1nc2cc(Cl)ccc2c(=O)n1CCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ USP2 O75604 1/20 0.47
▸ EGFR P00533 1/20 0.46
▸ KMT2A Q03164 3/20 0.44
▸ MAPK1 P28482 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ PLK1 P53350 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ ADORA2B P29275 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NPY1R P25929 1/20 0.40
▸ NPY2R P49146 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL7635781 0.93 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1EGFRKMT2ADPP4
SCHEMBL7643515 0.90 USP2 (0.47) SMN1; SMN2NPSR1USP2KMT2AMAPK1
SCHEMBL7638151 0.83 DPP4 (0.46) DPP4LMNATSHRRXFP1ALDH1A1
SCHEMBL5712364 0.82 ALDH1A1 (0.59) SMN1; SMN2USP2KMT2AMAPK1MEN1
SCHEMBL7887669 0.81 USP2 (0.48) SMN1; SMN2NPSR1USP2KMT2AMAPK1
SCHEMBL8700665 0.79 ALDH1A1 (0.52) SMN1; SMN2USP2MAPK1ALDH1A1
SCHEMBL192788 0.78 TP53 (0.51) SMN1; SMN2USP2MAPK1LMNAALDH1A1
SCHEMBL21925 0.78 USP2 (0.47) SMN1; SMN2USP2KMT2AMAPK1MEN1
SCHEMBL7645164 0.77 DPP4 (0.43) SMN1; SMN2KMT2AMEN1DPP4LMNA
SCHEMBL8423120 0.77 USP2 (0.46) SMN1; SMN2NPSR1USP2MAPK1LMNA

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-6413973-B1 SYNERGISTIC WITH A CYANO-PYROLE AND A PHENYLAMIDE AGAINST PHYTOPATHOGENIC FUNGI ON CROP PLANTS; TREATING SEEDS, PLANTS OR SOIL; WHEAT, RYE, BARLEY, MAIZE, CUCURBITS, LAWNS, COTTON, SOYBEANS, COFFEE, SUGARCANE, FRUITS, CUCUMBERS, BEANS SYNGENTA CROP PROTECTION, INC. 2002-07-02 — — US claimed
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