SCHEMBL4344157

SCHEMBL4344157

CCC(CC)C[C@](C)(N)C(=O)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 4/20 0.37
MEN1 O00255 1/20 0.37
F2 P00734 2/20 0.35
PRSS1 P07477 2/20 0.35
PRSS2 P07478 2/20 0.35
PRSS3 P35030 2/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 2/20 0.34
STAT3 P40763 1/20 0.34
GHSR Q92847 1/20 0.34
MAPT P10636 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL4269487 0.80 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL4344155 0.77 CYP2D6 (0.41) ALDH1A1KMT2AMEN1LMNAGHSR
SCHEMBL5724458 0.76 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL6255019 0.75 BLM (0.51) ALDH1A1KMT2AMEN1GAAGHSR
SCHEMBL9982800 0.75 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL7586365 0.75 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL29070867 0.74 STAT3 (0.41) ALDH1A1KMT2AMEN1GAALMNA
Ammonia Solution, Strong SCHEMBL2836007 0.74 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL2227741 0.74 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1F2PRSS1
SCHEMBL28674512 0.72 ALDH1A1 (0.50) ALDH1A1KMT2AF2PRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612226-B2 Amino acid derivatives PFIZER INC. (US) 2009-11-03 US disclosed
EP-1879567-A1 AMINO ACID DERIVATIVES Pfizer Limited (GB) 2008-01-23 EP disclosed
US-20060247291-A1 Amino acid derivatives PFIZER, INC. 2006-11-02 US disclosed
WO-2006114707-A1 AMINO ACID DERIVATIVES PFIZER LIMITED (GB) 2006-11-02 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-20060247291-A1 Amino acid derivatives OPRL1, BCAT2, BCAT1 ALDH1A1 1189/4885KMT2A 1916/4885MEN1 3595/4885

“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.