SCHEMBL21243350

SCHEMBL21243350

CC(C)(C)C1CCC(COC(=O)C2C3CCC(C3)C2C(=O)OCC2CCC(C(C)(C)C)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPA P38571 1/20 0.41
ALDH1A1 P00352 6/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 3/20 0.35
KDM4E B2RXH2 3/20 0.34
CYP3A4 P08684 2/20 0.34
RECQL P46063 1/20 0.34
ATM Q13315 1/20 0.34
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
EPHX1 P07099 1/20 0.33
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD11B1 P28845 1/20 0.32
GAA P10253 1/20 0.32
CYP19A1 P11511 1/20 0.31

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
SCHEMBL21243373 0.82 TLR4 (0.39) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL21243344 0.81 ALDH1A1 (0.40) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL21243355 0.81 ALDH1A1 (0.40) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL13762649 0.80 ALDH1A1 (0.41) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL21243363 0.79 MAPT (0.43) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL21243330 0.79 TP53 (0.49) LIPAALDH1A1CYP2C19MAPTKDM4E
SCHEMBL21243337 0.78 LIPA (0.39) LIPAALDH1A1MAPTKDM4ECYP3A4
SCHEMBL21243360 0.78 LMNA (0.49) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL15712947 0.78 LIPA (0.46) LIPAALDH1A1MAPTKDM4ERECQL
SCHEMBL6763398 0.77 PPM1B (0.41) ALDH1A1MEN1CYP1A2CYP2C9CYP2C19

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 LIPA 1122/4885ALDH1A1 1661/4885MEN1 2513/4885
US-20190249103-A1 LUBRICANT BASE OIL FOR POWER TRANSMISSION DNAH12, DYNC1LI1, DYNC1LI2 LIPA 1122/4885ALDH1A1 1661/4885MEN1 2513/4885

“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.