SCHEMBL5354058

SCHEMBL5354058

C=C(C)C(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.55
ALDH1A1 P00352 8/20 0.50
HPGD P15428 2/20 0.50
CYP19A1 P11511 2/20 0.49
TRPA1 O75762 2/20 0.43
TRPM8 Q7Z2W7 2/20 0.43
TSHR P16473 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
NFE2L2 Q16236 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL14559200 1.00 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL1320016 1.00 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
Methacrylic Acid SCHEMBL17603229 0.96 EPHX1 (0.51) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL28581609 0.90 EPHX1 (0.57) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL16194851 0.89 EPHX1 (0.61) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL6387314 0.89 EPHX1 (0.61) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL1335321 0.88 EPHX1 (0.52) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL8519624 0.88 EPHX1 (0.50) EPHX1ALDH1A1HPGDCYP19A1TSHR
SCHEMBL8396914 0.88 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL13430523 0.87 EPHX1 (0.57) EPHX1ALDH1A1HPGDCYP19A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107596927-B Chiral nanofiber composite membrane and preparation method thereof 北京化工大学 2020-12-11 CN claimed
US-20240384227-A1 MATERIALS CHEMISTRIES AND MICROTOPOGRAPHIES AND USES THEREOF THE UNIVERSITY OF NOTTINGHAM (GB) 2024-11-21 US disclosed
WO-2023202969-A1 ANTIBACTERIAL POLYMER AND PROCESS OF PREPARING THE SAME BASF SE (DE) 2023-10-26 WO disclosed
US-7186854-B2 Process for making bicalutamide and intermediates thereof SYNTHON IP INC. (US) 2007-03-06 US disclosed
US-7186854-B2 Process for making bicalutamide and intermediates thereof SYNTHON IP INC. (US) 2007-03-06 US disclosed
US-7186854-B2 Process for making bicalutamide and intermediates thereof SYNTHON IP INC. (US) 2007-03-06 US disclosed
US-6818766-B2 USING P-FLUOROBENZENESULFINIC ACID SYNTHON BV (NL) 2004-11-16 US disclosed
US-20040068135-A1 Process for making bicalutamide and intermediates thereof SYNTHON IP INC. 2004-04-08 US disclosed
US-20030073742-A1 Process for making bicalutamide and intermediates thereof SYNTHON B.V. (NL) 2003-04-17 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 (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-20030073742-A1 Process for making bicalutamide and intermediates thereof BLVRB, BRDT, OTUB1 EPHX1 2750/4885ALDH1A1 1010/4885HPGD 2295/4885
US-20040068135-A1 Process for making bicalutamide and intermediates thereof BLVRB, BRDT, OTUB1 EPHX1 2750/4885ALDH1A1 1010/4885HPGD 2295/4885

“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.