SCHEMBL248772

SCHEMBL248772

CCOC(=O)c1c(N)sc(C(=O)Nc2ccccc2C(F)(F)F)c1C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.75
NPC1 O15118 5/20 0.75
RAB9A P51151 5/20 0.75
NFKB1 P19838 3/20 0.75
NFKB2 Q00653 3/20 0.75
RELA Q04206 3/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
ALDH1A1 P00352 8/20 0.67
CISD2 Q8N5K1 6/20 0.62
GAA P10253 1/20 0.60
HTT P42858 1/20 0.60
APOBEC3G Q9HC16 1/20 0.60
SETD7 Q8WTS6 2/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HPGD P15428 4/20 0.52
POLB P06746 2/20 0.52
TP53 P04637 1/20 0.52
PKM P14618 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL8289765 0.84 ALDH1A1 (0.83) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL9400304 0.81 RAB9A (1.00) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL23657451 0.79 RAB9A (0.71) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL25106684 0.77 CISD2 (1.00) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL25106697 0.77 CISD2 (0.80) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL9732938 0.76 MAPT (0.78) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL10933328 0.75 POLB (0.51) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL25106671 0.75 CISD2 (1.00) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL13236165 0.75 ALDH1A1 (0.76) MAPTNPC1RAB9ANFKB1NFKB2
SCHEMBL30300650 0.75 CISD2 (1.00) MAPTNPC1RAB9ANFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130171158-A1 TREATMENT OF ABNORMALITIES OF GLUCOSE METABOLISM WITH AN ANTAGONIST OF INHIBITOR OF DIFFERENTIATION 1 GARVAN INSTITUTE OF MEDICAL RESEARCH (AU) 2013-07-04 US claimed
WO-2012000036-A1 TREATMENT OF ABNORMALITIES OF GLUCOSE METABOLISM WITH AN ANTAGONIST OF INHIBITOR OF DIFFERENTIATION 1 GARVAN INSTITUTE OF MEDICAL RESEARCH (AU) 2012-01-05 WO claimed
US-20130171158-A1 TREATMENT OF ABNORMALITIES OF GLUCOSE METABOLISM WITH AN ANTAGONIST OF INHIBITOR OF DIFFERENTIATION 1 GARVAN INSTITUTE OF MEDICAL RESEARCH (AU) 2013-07-04 US disclosed
US-8138356-B2 Chemical inhibitors of inhibitors of differentiation Angiogeney, Inc. (US) 2012-03-20 US disclosed
WO-2012000036-A1 TREATMENT OF ABNORMALITIES OF GLUCOSE METABOLISM WITH AN ANTAGONIST OF INHIBITOR OF DIFFERENTIATION 1 GARVAN INSTITUTE OF MEDICAL RESEARCH (AU) 2012-01-05 WO 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-20130171158-A1 TREATMENT OF ABNORMALITIES OF GLUCOSE METABOLISM WITH AN ANTAGONIST OF INHIBITOR OF DIFFERENTIATION 1 FBP1, G6PC1, G6PD MAPT 4187/4885NPC1 1637/4885RAB9A 4386/4885

“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.