SCHEMBL12417308

SCHEMBL12417308

CC(C)C1=CCC2C(=C1)CCC1C(C)(OC=O)CCCC21C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.38
▸ HSD17B10 Q99714 3/20 0.36
▸ ALOX15 P16050 3/20 0.36
▸ PDK1 Q15118 2/20 0.36
▸ PDK2 Q15119 2/20 0.36
▸ PDK3 Q15120 2/20 0.36
▸ PDK4 Q16654 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ SLCO1B3 Q9NPD5 1/20 0.36
▸ SLCO1B1 Q9Y6L6 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB2 P47870 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP19A1 P11511 1/20 0.35
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL30203391 0.84 CYP3A4 (0.43) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL29391021 0.82 CYP19A1 (0.48) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL17715453 0.81 MMP2 (0.39) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL152259 0.78 MMP2 (0.64) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL152258 0.78 MMP2 (0.64) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL2603445 0.78 MMP2 (0.64) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL20061643 0.78 MMP2 (0.64) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL11029865 0.78 MMP2 (0.64) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL20067895 0.78 MMP2 (0.52) MMP2HSD17B10ALOX15PDK1PDK2
SCHEMBL19879575 0.78 MMP2 (0.52) MMP2HSD17B10ALOX15PDK1PDK2

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-9029566-B2 Rosin derived epoxides and curing agents WASHINGTON STATE UNIVERSITY (US) 2015-05-12 — — US disclosed
US-20110172440-A1 ROSIN DERIVED EPOXIDES AND CURING AGENTS ZHANG JINWEN 2011-07-14 — — 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-20110172440-A1 ROSIN DERIVED EPOXIDES AND CURING AGENTS EPHX1, EPHX2, RCOR1 MMP2 4064/4885HSD17B10 2751/4885ALOX15 102/4885

“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.

Send feedback