SCHEMBL25329971

SCHEMBL25329971

CCCOc1c(C)c(CC)c(O)c(CC)c1C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
TLR4 O00206 1/20 0.31
PTPRC P08575 3/20 0.31
PTPN2 P17706 3/20 0.31
PTPN1 P18031 3/20 0.31
PTPRB P23467 3/20 0.31
PTPN11 Q06124 3/20 0.31
GSTA1 P08263 2/20 0.31
GSTP1 P09211 2/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
CREB1 P16220 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
SCHEMBL25328268 0.92 PTGS1 (0.33) LTA4HPTGS1PTGS2CYP1A2CYP2C19
SCHEMBL25329110 0.92 PTGS1 (0.33) LTA4HPTGS1PTGS2
SCHEMBL25329044 0.88 PTGS1 (0.33) LTA4HPTGS1PTGS2
SCHEMBL25329527 0.88 LTA4H (0.40) LTA4HCYP1A2CYP2C19TLR4GSTA1
SCHEMBL25329550 0.84 LTA4H (0.35) LTA4HPTGS1PTGS2TLR4PTPRC
SCHEMBL25329867 0.82 CYP1A2 (0.37) LTA4HCYP1A2CYP2C19GAA
SCHEMBL28975000 0.82 LTA4H (0.36) LTA4HPTGS1PTGS2TLR4PTPRC
SCHEMBL25328718 0.82 LTA4H (0.36) LTA4HPTGS1PTGS2TLR4PTPRC
SCHEMBL25327716 0.82 PTGS1 (0.32) LTA4HPTGS1PTGS2
SCHEMBL25329481 0.82 PTGS1 (0.32) LTA4HPTGS1PTGS2

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-12583813-B2 Polymerization inhibitors BASF SE (DE) 2026-03-24 US disclosed
US-20230242472-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2023-08-03 US disclosed
CN-115697954-A Polymerization inhibitor 巴斯夫欧洲公司 2023-02-03 CN 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 (2 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-20230242472-A1 POLYMERIZATION INHIBITORS RCE1, CABLES1, DPYD LTA4H 1432/4885PTGS1 474/4885PTGS2 594/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 LTA4H 323/4885PTGS1 1/4885PTGS2 8/4885

“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.