SCHEMBL3773593

SCHEMBL3773593

CCc1nc(Nc2ccccc2F)nc(N)c1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
POLB P06746 2/20 0.45
RAB9A P51151 6/20 0.43
NPC1 O15118 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ATM Q13315 1/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TTK P33981 1/20 0.39
RAD52 P43351 1/20 0.39
LMNA P02545 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
SCHEMBL4060122 0.81 MAPT (0.63) MAPTPOLBRAB9ASMN1; SMN2MEN1
SCHEMBL17110620 0.74 POLB (0.56) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL1266706 0.68 TP53 (0.34) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL16147156 0.68 TTK (0.46) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL17220221 0.67 TSHR (0.53) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL16147157 0.67 POLA1 (0.53) RAB9ATTKCDK2
SCHEMBL30523365 0.67 POLA1 (0.53) RAB9ATTKCDK2
SCHEMBL17110632 0.67 KCNH3 (0.51) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL2450994 0.67 RAB9A (0.50) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL13395042 0.66 TSHR (0.67) MAPTPOLBRAB9ANPC1SMN1; SMN2

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-20120122892-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-05-17 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-20120122892-A1 CHEMICAL COMPOUNDS TP53, XPOT, KRAS MAPT 1265/4885POLB 1755/4885RAB9A 872/4885

“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.