SCHEMBL6156538

SCHEMBL6156538

CSc1cc(OCCC[Si](C)(C)C)c(Cl)cc1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
DHFR P00374 4/20 0.36
MAOA P21397 1/20 0.36
ALDH1A1 P00352 2/20 0.34
S1PR4 O95977 4/20 0.31
GLA P06280 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
CSNK2A1 P68400 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6157675 0.81 DHFR (0.42) GAADHFRMAOAALDH1A1S1PR4
SCHEMBL6361283 0.78 S1PR4 (0.40) ALDH1A1S1PR4SMN1; SMN2MAPTCYP2C9
SCHEMBL6357689 0.75 LMNA (0.31) ALDH1A1NPSR1
SCHEMBL6357690 0.75 LMNA (0.31) ALDH1A1NPSR1
SCHEMBL6371307 0.73 GAA (0.68) GAAALDH1A1HSP90AA1HSP90AB1MEN1
SCHEMBL6357691 0.71
SCHEMBL8444669 0.68 GAA (0.60) GAAALDH1A1SMN1; SMN2MEN1POLB
SCHEMBL4404101 0.67 S1PR4 (0.42) ALDH1A1S1PR4SMN1; SMN2MEN1POLB
SCHEMBL26930436 0.66 CYP1A2 (0.52) GAADHFRMAOAALDH1A1GLA
SCHEMBL6161762 0.66 S1PR4 (0.44) ALDH1A1S1PR4SMN1; SMN2MAPTCYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050182025-A1 Amidinylphenyl compounds and their use as fungicides E. I. DU PONT DE NEMOURS AND COMPANY 2005-08-18 US disclosed
EP-1501789-A1 AMIDINYLPHENYL COMPOUNDS AND THEIR USE AS FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2005-02-02 EP disclosed
WO-2003093224-A1 AMIDINYLPHENYL COMPOUNDS AND THEIR USE AS FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-11-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050182025-A1 Amidinylphenyl compounds and their use as fungicides OR10J3, CBR3, C3AR1 GAA 4283/4885DHFR 1514/4885MAOA 1239/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.