SCHEMBL21981027

SCHEMBL21981027

CCOC[C@H](CCc1ccccc1)OS(=O)(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.41
TSHR P16473 2/20 0.37
ALDH1A1 P00352 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MCL1 Q07820 1/20 0.36
CYP24A1 Q07973 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MMP12 P39900 2/20 0.35
POLB P06746 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
MMP7 P09237 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL9773201 0.75 SMN1; SMN2 (0.46) BLMSMN1; SMN2TAAR1
SCHEMBL5674353 0.75 SMN1; SMN2 (0.46) BLMSMN1; SMN2TAAR1
SCHEMBL1858577 0.75 SMN1; SMN2 (0.46) BLMSMN1; SMN2TAAR1
SCHEMBL8935817 0.73 CASP3 (0.48) BLMALDH1A1KDM4ESMN1; SMN2CA1
SCHEMBL7425913 0.71 PPARG (0.50) BLMMMP7
SCHEMBL6515182 0.71 PPARG (0.50) BLMMMP7
SCHEMBL20607556 0.71 PPARG (0.40) TSHRALDH1A1SMN1; SMN2MMP12POLB
SCHEMBL1030314 0.71 PPARG (0.40) TSHRALDH1A1SMN1; SMN2MMP12POLB
SCHEMBL10680554 0.71 CTSK (0.43) TSHRALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7728941 0.70 MEN1 (0.43) BLMTSHRALDH1A1CYP1A2CYP2C9

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-10633329-B2 Method for preparing lisinopril intermediate ZHEJIANG HUAHAI PHARMACEUTICAL CO., LTD. (CN) 2020-04-28 US 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-10633329-B2 Method for preparing lisinopril intermediate PKLR, PHYKPL, ACE BLM 3111/4885TSHR 3518/4885ALDH1A1 577/4885

“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.