SCHEMBL17340719

SCHEMBL17340719

CC[C@]12CC[C@@](C)(OC(C)=O)C(C)(C)C1CC[C@H]2C

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.51
▸ CYP17A1 P05093 3/20 0.36
▸ CYP19A1 P11511 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ MAPK1 P28482 1/20 0.35

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
SCHEMBL18827057 0.79 ALOX15 (0.36) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
SCHEMBL24066735 0.78 ALOX15 (0.37) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
SCHEMBL10086308 0.77 ALOX15 (0.35) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL8739817 0.75 ALOX15 (0.46) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
SCHEMBL18827095 0.73 ALOX15 (0.40) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
Cedryl Acetate SCHEMBL8515562 0.68 ALOX15 (1.00) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
Cedryl Acetate SCHEMBL30392817 0.68 ALOX15 (1.00) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
Cedryl Acetate SCHEMBL8737981 0.68 ALOX15 (1.00) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
Cedryl Acetate SCHEMBL18604009 0.68 ALOX15 (1.00) ALOX15CYP17A1CYP19A1ALDH1A1LMNA
Cedryl Acetate SCHEMBL18138231 0.68 ALOX15 (1.00) ALOX15CYP17A1CYP19A1ALDH1A1LMNA

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-20210369640-A1 COMPOSITION CONTAINING SESQUITERPENE DERIVATIVE AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF MUSCLE DISEASES INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2021-12-02 — — US disclosed
EP-2331089-B1 USES OF SESQUITERPENE DERIVATIVES KWANG DONG PHARM CO LTD (KR) 2015-12-16 — — EP 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-20210369640-A1 COMPOSITION CONTAINING SESQUITERPENE DERIVATIVE AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF MUSCLE DISEASES TNNC1, TNNI3, PYGM ALOX15 166/4885CYP17A1 483/4885CYP19A1 1487/4885

“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