SCHEMBL10040223

SCHEMBL10040223

CCOC(=O)[C@H](C)CC(C)(C)[Si](C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
MMP8 P22894 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.32
HSD17B10 Q99714 1/20 0.32
PIN1 Q13526 1/20 0.32
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
CPB2 Q96IY4 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL4550792 0.83 SMN1; SMN2 (0.33) ALDH1A1MMP8
SCHEMBL13761744 0.83 SMN1; SMN2 (0.33) ALDH1A1MMP8
SCHEMBL28291065 0.78 MMP8 (0.43) ALDH1A1HPGDMMP8CYP3A4CYP2C19
SCHEMBL17147639 0.75
SCHEMBL14770933 0.74 CYP3A4 (0.34) ALDH1A1HPGDCYP3A4CYP2C19GAA
SCHEMBL14593938 0.73 MMP8 (0.47) ALDH1A1MMP8CYP3A4CYP2C19GAA
SCHEMBL28684989 0.73 MMP8 (0.40) ALDH1A1HPGDMMP8CYP3A4CYP2C19
SCHEMBL2617898 0.73 MMP8 (0.40) ALDH1A1MMP8CYP3A4CYP2C19GAA
SCHEMBL7767166 0.72 ALDH1A1 (0.39) ALDH1A1HPGDMMP8CYP3A4CYP2C19
SCHEMBL12598259 0.70 MMP8 (0.45) ALDH1A1HPGDMMP8CYP3A4CYP2C19

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-8168648-B2 Camptothecin derivatives and uses thereof TAIWAN LIPOSOME CO., LTD. (TW) 2012-05-01 US disclosed
US-20100227877-A1 NEW CAMPTOTHECIN DERIVATIVES AND USES THEREOF TAIWAN LIPOSOME CO. LTD. (TW) 2010-09-09 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-20100227877-A1 NEW CAMPTOTHECIN DERIVATIVES AND USES THEREOF LDHA, LDHB, TOP2A ALDH1A1 1223/4885HPGD 908/4885MMP8 2734/4885

“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.