SCHEMBL1695174

SCHEMBL1695174

CC(=O)c1cc2c(F)cccc2nc1C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
HSD17B10 Q99714 2/20 0.45
TP53 P04637 1/20 0.45
PDE10A Q9Y233 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 3/20 0.40
LMNA P02545 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39

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
SCHEMBL1695203 0.82 ESR1 (0.37) SMN1; SMN2HSD17B10TP53PDE10AKMT2A
SCHEMBL14815892 0.82 ESR1 (0.37) SMN1; SMN2HSD17B10TP53PDE10AKMT2A
SCHEMBL14815893 0.82 ESR1 (0.37) SMN1; SMN2HSD17B10TP53PDE10AKMT2A
SCHEMBL24950821 0.81 TSHR (0.60) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL31133620 0.81 TSHR (0.60) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL1694720 0.78 KMT2A (0.45) SMN1; SMN2HSD17B10TP53KMT2AMEN1
SCHEMBL15660706 0.77 ALDH1A1 (0.55) SMN1; SMN2HSD17B10TP53PDE10AKMT2A
SCHEMBL2719330 0.76 SMN1; SMN2 (0.52) SMN1; SMN2HSD17B10TP53KMT2AMEN1
SCHEMBL24596021 0.76 SMN1; SMN2 (0.47) SMN1; SMN2HSD17B10KMT2AMEN1KDM4E
SCHEMBL7915323 0.75 SMN1; SMN2 (0.59) SMN1; SMN2HSD17B10TP53KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588467-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 EP disclosed
US-20130085131-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-04 US disclosed
US-20130085131-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-04 US disclosed
US-20130085131-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-04 US disclosed
WO-2012003274-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed
WO-2012003274-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 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-20130085131-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, SSB, BCL9 SMN1; SMN2 411/4885HSD17B10 3361/4885TP53 227/4885

“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.