SCHEMBL21683371

SCHEMBL21683371

CC(C)=C1C=C2CC[C@H]3C(C)(C)CCC[C@]3(C)[C@H]2CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.52
▸ MMP2 P08253 1/20 0.50
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ CYP2C9 P11712 3/20 0.39
▸ CYP2C19 P33261 3/20 0.39
▸ TRPV1 Q8NER1 1/20 0.36
▸ ALOX15 P16050 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ MAPT P10636 2/20 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
SCHEMBL2754764 0.83 MMP2 (0.74) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL2603444 0.83 MMP2 (0.74) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL1439573 0.83 MMP2 (0.74) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL18328548 0.83 MMP2 (0.74) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL15313391 0.83 MMP2 (0.74) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL17715454 0.75 MMP2 (0.43) CYP19A1MMP2PTPN1CYP2C9CYP2C19
SCHEMBL9334177 0.74 MMP2 (0.55) CYP19A1MMP2PTPN2PTPN1CYP2C9
SCHEMBL15072074 0.74 MMP2 (0.49) MMP2PTPN2PTPN1CYP2C9CYP2C19
SCHEMBL16906147 0.72 MMP2 (0.40) MMP2CYP2C9CYP2C19ALOX15ALDH1A1
SCHEMBL18949252 0.70 CYP19A1 (0.60) CYP19A1MMP2PTPN2PTPN1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025042871-A1 ENCODING CYCLIC TERPENOIDS INTO ISOMERIC MODULAR SUBSTRATES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2025-02-27 — — WO disclosed
US-11566265-B2 Microbial engineering for the production of chemical and pharmaceutical products from the isoprenoid pathway MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-01-31 — — US disclosed
US-20210395763-A1 IMPROVED PRODUCTION OF TERPENOIDS USING ENZYMES ANCHORED TO LIPID DROPLET SURFACE PROTEINS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2021-12-23 — — US disclosed
EP-3833754-A2 IMPROVED PRODUCTION OF TERPENOIDS USING ENZYMES ANCHORED TO LIPID DROPLET SURFACE PROTEINS Board of Trustees of Michigan State University (US) 2021-06-16 — — EP disclosed
WO-2020033705-A2 IMPROVED PRODUCTION OF TERPENOIDS USING ENZYMES ANCHORED TO LIPID DROPLET SURFACE PROTEINS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2020-02-13 — — 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-20210395763-A1 IMPROVED PRODUCTION OF TERPENOIDS USING ENZYMES ANCHORED TO LIPID DROPLET SURFACE PROTEINS FADS2, SCD, FADS1 CYP19A1 458/4885MMP2 3568/4885PTPN2 4680/4885

“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.

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