SCHEMBL21243357

SCHEMBL21243357

CC1CCC(COC(=O)C2C3CCC(C3)C2C(=O)OCC2CCC(C)C(C)C2)CC1C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
PPM1B O75688 2/20 0.32
PTPN1 P18031 2/20 0.32
PPP1CC P36873 2/20 0.32

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
SCHEMBL21243355 0.83 ALDH1A1 (0.40) MEN1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL21243371 0.80 TP53 (0.36)
SCHEMBL21243354 0.80 TP53 (0.49)
SCHEMBL21243344 0.79 ALDH1A1 (0.40) MEN1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL17106333 0.79 LMNA (0.33) ALDH1A1
SCHEMBL17106331 0.79 LMNA (0.33) ALDH1A1
SCHEMBL17106335 0.79 LMNA (0.33) ALDH1A1
SCHEMBL21243349 0.79 TP53 (0.37)
SCHEMBL13762649 0.77 ALDH1A1 (0.41) MEN1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL21243373 0.77 TLR4 (0.39) MEN1ALDH1A1CYP1A2CYP2C9CYP2C19

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-10947472-B2 Lubricant base oil for power transmission NEW JAPAN CHEMICAL CO., LTD. (JP) 2021-03-16 US disclosed
US-20190249103-A1 LUBRICANT BASE OIL FOR POWER TRANSMISSION NEW JAPAN CHEMICAL CO., LTD. (JP) 2019-08-15 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-10947472-B2 Lubricant base oil for power transmission DNAH12, DYNC1LI1, DYNC1LI2 MEN1 2513/4885ALDH1A1 1661/4885CYP1A2 3601/4885
US-20190249103-A1 LUBRICANT BASE OIL FOR POWER TRANSMISSION DNAH12, DYNC1LI1, DYNC1LI2 MEN1 2513/4885ALDH1A1 1661/4885CYP1A2 3601/4885

“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.