SCHEMBL25919645

SCHEMBL25919645

CS(=O)(=O)C1(c2ccc(O)cc2)CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.38
MMP2 P08253 3/20 0.38
MMP13 P45452 2/20 0.38
MMP14 P50281 2/20 0.38
MMP1 P03956 1/20 0.38
ESR2 Q92731 3/20 0.37
ESR1 P03372 2/20 0.37
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33
CYP2C19 P33261 1/20 0.33
RORC P51449 2/20 0.33
ATR Q13535 2/20 0.33
MMP9 P14780 2/20 0.33
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL25317909 0.87 ENPP2 (0.45) ENPP2MMP2ESR2ESR1CYP3A4
SCHEMBL25317313 0.84 ESR2 (0.45) ENPP2MMP2ESR2ESR1CYP3A4
SCHEMBL25314568 0.82 ENPP2 (0.41) ENPP2MMP2ESR2ESR1CYP3A4
SCHEMBL25314674 0.77 ENPP2 (0.36) ENPP2MMP2ESR2ESR1CYP3A4
SCHEMBL8701053 0.76 CA12 (0.34) RORCATRPTGS1PTGS2PIK3CA
SCHEMBL25919647 0.76 MMP13 (0.43) MMP2MMP13MMP1CYP3A4CYP2C9
SCHEMBL26038573 0.74 RORC (0.53) MMP2MMP13MMP1RORCALDH1A1
SCHEMBL25902478 0.74 TSHR (0.47) MMP2MMP13MMP1CYP3A4CYP2C9
SCHEMBL25318482 0.74 ENPP2 (0.39) ENPP2MMP2ESR2ESR1CYP3A4
SCHEMBL26028023 0.73 ALDH1A1 (0.39) MMP2MMP13MMP1MMP9ALDH1A1

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-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE HERCULES CAPITAL, INC., AS AGENT 2023-08-24 US disclosed
WO-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 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-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE APOL1, APOB, LDLR ENPP2 123/4885MMP2 1090/4885MMP13 835/4885

“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.