SCHEMBL6765615

SCHEMBL6765615

COc1ccc(COC(=O)c2ccc3c(c2)CN(C(=O)c2ccc(C(=O)O)cc2)C3)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 3/20 0.47
PLA2G4B P0C869 1/20 0.46
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
DRD2 P14416 2/20 0.42
RXRA P19793 2/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL6766448 0.83 NAMPT (0.61) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL6766906 0.81 NPC1 (0.46) SMN1; SMN2NPC1RAB9APOLBHPGD
SCHEMBL10636593 0.79 NPC1 (0.71) SMN1; SMN2NPC1RAB9APOLBHPGD
SCHEMBL7399657 0.78 NPC1 (0.69) SMN1; SMN2NPC1RAB9APOLBHPGD
SCHEMBL6765613 0.77 MEN1 (0.52) SMN1; SMN2NPC1RAB9APOLBPLA2G4B
SCHEMBL23329441 0.76 CA1 (0.67) HPGDCA1CA2CA7CA9
SCHEMBL29373515 0.76 CA1 (0.67) HPGDCA1CA2CA7CA9
SCHEMBL6754368 0.75 NPC1 (0.44) SMN1; SMN2NPC1RAB9APOLBPLA2G4B
SCHEMBL16689961 0.74 KMT2A (0.67) SMN1; SMN2NPC1RAB9APOLBHPGD
SCHEMBL6754372 0.74 MAPK1 (0.43) SMN1; SMN2NPC1RAB9APOLBPLA2G4B

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-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis NAHRA JOE (US) 2004-02-26 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-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis MMP13, MMP11, MMP9 SMN1; SMN2 984/4885NPC1 1199/4885RAB9A 425/4885

“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.