SCHEMBL25328765

SCHEMBL25328765

Cc1cc(OCC(C)C)c(C)cc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 2/20 0.40
HIF1A Q16665 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
G6PD P11413 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
CCR6 P51684 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
XDH P47989 1/20 0.39

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
SCHEMBL13475558 0.88 ALDH1A1 (0.48) ALDH1A1GAAMAPTHIF1AALOX15
SCHEMBL25329513 0.82 ALOX15 (0.41) ALDH1A1GAAMAPTHIF1APKM
SCHEMBL25329407 0.82 ALDH1A1 (0.40) ALDH1A1GAAMAPTHIF1AHPGD
SCHEMBL9704738 0.78 ESR1 (0.51) ALDH1A1GAAMAPTHIF1AKDM4E
SCHEMBL19121898 0.77 ALDH1A1 (0.41) ALDH1A1GAAMAPTHIF1ACYP3A4
SCHEMBL25328287 0.76 ALDH1A1 (0.43) ALDH1A1GAAMAPTHIF1AXDH
SCHEMBL25329065 0.74 ESR1 (0.46) ALDH1A1MAPTHIF1AKDM4ECYP1A2
SCHEMBL25329769 0.74 MAPT (0.44) ALDH1A1MAPTHIF1AKDM4ECYP1A2
SCHEMBL7525902 0.73 MAPT (0.40) ALDH1A1MAPTHIF1AKDM4ECYP1A2
SCHEMBL20804855 0.73 ALDH1A1 (0.41) ALDH1A1GAAMAPTHIF1ACYP3A4

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 ALDH1A1 1314/4885GAA 180/4885MAPT 1359/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 ALDH1A1 32/4885GAA 3196/4885MAPT 2405/4885

“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.