SCHEMBL304543

SCHEMBL304543

Cn1cc(-c2ccc3c(c2)NCCO3)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.53
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PDE3B Q13370 2/20 0.48
PDE3A Q14432 2/20 0.48
PRKCI P41743 1/20 0.46
SYK P43405 3/20 0.42
LOXL2 Q9Y4K0 1/20 0.40
ACVR1 Q04771 1/20 0.40
AXL P30530 1/20 0.40
PIK3CD O00329 4/20 0.40
PIK3CA P42336 4/20 0.40
PIK3CB P42338 3/20 0.40
PIK3CG P48736 3/20 0.40
FYN P06241 1/20 0.40
PIM1 P11309 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
PI4KA P42356 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
SCHEMBL23930118 0.89 AXL (0.43) BRD4ALDH1A1GAAMAPTHSD17B10
SCHEMBL17795291 0.79 KDM4E (0.51) GAAMAPTLOXL2ACVR1AXL
SCHEMBL304000 0.78 ALDH1A1 (0.42) BRD4ALDH1A1GAAMAPTHSD17B10
SCHEMBL30480844 0.77 PIM1 (0.48) MAPTSYKFYNPIM1PIM2
SCHEMBL3278267 0.77 ALDH1A1 (0.53) BRD4ALDH1A1GAAMAPTHSD17B10
SCHEMBL17809644 0.76 AXL (0.41) BRD4LOXL2ACVR1AXLPIK3CD
SCHEMBL31542263 0.76 AXL (0.41) BRD4LOXL2ACVR1AXLPIK3CD
SCHEMBL303421 0.76 ALDH1A1 (0.56) BRD4ALDH1A1GAAMAPTHSD17B10
SCHEMBL17785716 0.75 KDM1A (0.48) BRD4LOXL2ACVR1AXLPIK3CD
SCHEMBL17799353 0.75 PDE3B (0.46) BRD4ALDH1A1GAAMAPTHSD17B10

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-8093238-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-01-10 US disclosed
US-20100069361-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-03-18 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-20100069361-A1 Fused Thiazole Derivatives as Kinase Inhibitors JAK1, MTOR, MOK BRD4 926/4885ALDH1A1 1714/4885GAA 1343/4885

“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.