SCHEMBL20799494

SCHEMBL20799494

CCC(C)OC(=O)c1cnc2cc3c(cc2c1)OCO3

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 6/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 3/20 0.44
RXFP1 Q9HBX9 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
NPC1 O15118 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
RAB9A P51151 4/20 0.43
NPSR1 Q6W5P4 3/20 0.43
PPARG P37231 2/20 0.43
NCOA2 Q15596 2/20 0.43
NCOA1 Q15788 2/20 0.43
NCOA3 Q9Y6Q9 2/20 0.43
HSD17B10 Q99714 3/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 4/20 0.41

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
SCHEMBL20799489 0.87 ALDH1A1 (0.53) L3MBTL1KMT2AATMALDH1A1MAPT
SCHEMBL17384693 0.82 LMNA (0.52) L3MBTL1KMT2AALDH1A1MAPTHPGD
SCHEMBL20799483 0.80 ALDH1A1 (0.50) L3MBTL1KMT2AATMALDH1A1MAPT
SCHEMBL18987868 0.74 MAOB (0.51) L3MBTL1KMT2AALDH1A1MAPTHPGD
SCHEMBL5553780 0.74 MGAM (0.51) L3MBTL1KMT2AATMALDH1A1MAPT
SCHEMBL20799492 0.73 MAOB (0.47) L3MBTL1KMT2AALDH1A1MAPTHPGD
Hydrogen Sulfide SCHEMBL28775857 0.73 MGAM (0.50) L3MBTL1KMT2AATMALDH1A1MAPT
SCHEMBL19020788 0.72 KDM4E (0.49) L3MBTL1KMT2AATMALDH1A1MAPT
Urea SCHEMBL6016094 0.71 MGAM (0.47) KMT2AALDH1A1MAPTHPGDTDP1
SCHEMBL11997780 0.70 PDGFRB (0.47) L3MBTL1KMT2AATMALDH1A1MAPT

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-10227355-B2 Quinoline derivatives and preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2019-03-12 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-10227355-B2 Quinoline derivatives and preparation thereof ABL1, FLT3, MAP3K7 L3MBTL1 4664/4885KMT2A 870/4885ATM 456/4885

“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.