SCHEMBL16222771

SCHEMBL16222771

CCCC[C@](CSC(C)(C)C)(C(=O)O)C(=O)OCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP4F2 P78329 3/20 0.37
CYP4A11 Q02928 3/20 0.37
MAPT P10636 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.34
THRB P10828 1/20 0.34
PKM P14618 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
GAA P10253 1/20 0.32
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL16222714 1.00 MEN1 (0.38) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222628 1.00 MEN1 (0.38) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222502 0.92 MEN1 (0.41) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222793 0.91 MEN1 (0.40) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222673 0.91 MEN1 (0.40) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222641 0.91 MEN1 (0.40) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL16222722 0.86 AR (0.33) KMT2AL3MBTL1
SCHEMBL16222794 0.86 AR (0.33) KMT2AL3MBTL1
SCHEMBL16222630 0.86 AR (0.33) KMT2AL3MBTL1
SCHEMBL17622442 0.84 SOAT1 (0.38) MEN1KMT2ACYP4F2CYP4A11MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160083341-A1 METHOD FOR PRODUCING a-SUBSTITUTED CYSTEINE OR SALT THEREOF OR SYNTHETIC INTERMEDIATE OF a-SUBSTITUTED CYSTEINE API CORPORATION (JP) 2016-03-24 US disclosed
WO-2014178433-A1 METHOD FOR PRODUCING α-SUBSTITUTED CYSTEINE OR SALT THEREOF OR INTERMEDIATE FOR SYNTHESIS OF α-SUBSTITUTED CYSTEINE 株式会社エーピーアイ コーポレーション (JP) 2014-11-06 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-20160083341-A1 METHOD FOR PRODUCING a-SUBSTITUTED CYSTEINE OR SALT THEREOF OR SYNTHETIC INTERMEDIATE OF a-SUBSTITUTED CYSTEINE MGMT, GSTA1, CBS MEN1 3023/4885KMT2A 1689/4885CYP4F2 104/4885

“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.