SCHEMBL3451371

SCHEMBL3451371

Fc1ccc(Nc2ncc(Br)c(N3CCC(N4CCOCC4)CC3)n2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
EGFR P00533 2/20 0.45
AURKA O14965 2/20 0.44
AURKB Q96GD4 2/20 0.44
TDO2 P48775 1/20 0.44
JAK2 O60674 5/20 0.43
JAK3 P52333 5/20 0.43
JAK1 P23458 4/20 0.43
MAPK1 P28482 1/20 0.42
TYK2 P29597 2/20 0.42
SYK P43405 2/20 0.42
FGFR4 P22455 1/20 0.41
KDR P35968 1/20 0.41
IGF1R P08069 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL3344180 0.90 NPC1 (0.53) NPC1RAB9ASMN1; SMN2EGFRAURKA
SCHEMBL3450656 0.89 MAPK1 (0.49) NPC1RAB9ASMN1; SMN2EGFRTDO2
SCHEMBL3452065 0.85 IRAK4 (0.42) FGFR1NPC1RAB9ASMN1; SMN2EGFR
SCHEMBL3450341 0.84 MAPK1 (0.46) EGFRJAK3MAPK1
SCHEMBL3449764 0.83 MAPK1 (0.51) NPC1RAB9ASMN1; SMN2EGFRMAPK1
SCHEMBL3452720 0.83 MAPK1 (0.51) NPC1RAB9ASMN1; SMN2EGFRJAK3
SCHEMBL3450023 0.82 MAPK1 (0.50) EGFRJAK3MAPK1
SCHEMBL3449638 0.82 MAPK1 (0.50) EGFRJAK3MAPK1
SCHEMBL3451168 0.82 MAPK1 (0.44) NPC1RAB9ASMN1; SMN2EGFRMAPK1
SCHEMBL3447770 0.81 NPC1 (0.56) NPC1RAB9ASMN1; SMN2JAK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD FGFR1 3917/4885NPC1 603/4885RAB9A 2449/4885

“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.