SCHEMBL20848641

SCHEMBL20848641

CC1(C(=O)Oc2ccc(C(C)(CCC(=O)OCc3ccccc3)c3ccc(OC(=O)C4(C)COC(=O)OC4)cc3)cc2)COC(=O)OC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.35
ALDH1A1 P00352 4/20 0.34
ESR1 P03372 1/20 0.34
CYP3A4 P08684 1/20 0.34
ESR2 Q92731 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 2/20 0.33
POLB P06746 3/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 2/20 0.33
EPHX2 P34913 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTR2C P28335 1/20 0.32
TSHR P16473 1/20 0.32
NOTUM Q6P988 1/20 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
SCHEMBL16016780 0.77 MAOB (0.50) L3MBTL1LMNAPOLBGAAMAPT
SCHEMBL846827 0.76 ALDH1A1 (0.47) ALDH1A1L3MBTL1MAPK1KMT2ADDB1
SCHEMBL20848640 0.75 MAPT (0.38) L3MBTL1LMNAPOLBGAAMAPT
SCHEMBL17589271 0.75 L3MBTL1 (0.50) ALDH1A1L3MBTL1POLBGAAMAPT
SCHEMBL20848639 0.74 ALDH1A1 (0.39) ALDH1A1L3MBTL1MAPK1LMNAPOLB
SCHEMBL20848344 0.73 POLB (0.40) ALDH1A1L3MBTL1MAPK1LMNAPOLB
SCHEMBL24885613 0.72 NAAA (0.44) ALDH1A1L3MBTL1MAPK1LMNAPOLB
SCHEMBL20848347 0.70 CYP3A4 (0.39) ALDH1A1CYP3A4POLBMEN1KMT2A
SCHEMBL20848342 0.70 POLB (0.38) ALDH1A1L3MBTL1MAPK1LMNAPOLB
SCHEMBL15198823 0.68 NAAA (0.41) ALDH1A1CYP3A4L3MBTL1MAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190091338-A1 MIKTO-ARM STAR POLYMERS FOR DELIVERY OF THERAPEUTIC AGENTS INTERNATIONAL BUSINESS MACHINES CORPORATION 2019-03-28 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-20190091338-A1 MIKTO-ARM STAR POLYMERS FOR DELIVERY OF THERAPEUTIC AGENTS COQ8A, COQ8B, STARD7 LIPE 3293/4885ALDH1A1 4420/4885ESR1 797/4885

“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.