SCHEMBL21446983

SCHEMBL21446983

CNC(=O)c1cc(-c2ccc(O)c(O)c2)on1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.59
PIM1 P11309 1/20 0.59
GSK3B P49841 1/20 0.59
NPC1 O15118 9/20 0.54
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
RAB9A P51151 6/20 0.54
TP53 P04637 4/20 0.50
MLLT1 Q03111 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MLLT3 P42568 2/20 0.50
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
POLB P06746 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL6802996 0.84 TP53 (0.68) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL24376430 0.83 MLLT1 (0.71) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL19245571 0.81 ROCK2 (0.57) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL3219488 0.80 RAB9A (0.72) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL10153708 0.80 ALDH1A1 (0.67) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL24376323 0.79 MLLT1 (0.49) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL21446984 0.79 MLLT1 (0.60) NPC1MEN1KMT2ARAB9ATP53
SCHEMBL22322454 0.78 HPGD (0.55) ROCK2PIM1GSK3BNPC1KMT2A
SCHEMBL21447026 0.77 MLLT1 (0.53) ROCK2PIM1GSK3BNPC1MEN1
SCHEMBL6801568 0.75 RAB9A (0.53) ROCK2PIM1GSK3BNPC1MEN1

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-10738040-B2 Compounds, compositions, and methods for increasing CFTR activity PROTEOSTASIS THERAPEUTICS, INC. (US) 2020-08-11 US disclosed
US-20190308960-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2019-10-10 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-20190308960-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY CFTR, ABCB4, SCNN1B ROCK2 3219/4885PIM1 4623/4885GSK3B 2766/4885
US-10738040-B2 Compounds, compositions, and methods for increasing CFTR activity CFTR, ABCB4, SCNN1B ROCK2 3219/4885PIM1 4623/4885GSK3B 2766/4885

“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.