SCHEMBL3817655

SCHEMBL3817655

Fc1ccc2oc(Nc3ccc(Br)cc3F)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
KCNH2 Q12809 2/20 0.41
FAAH O00519 1/20 0.41
C1R P00736 1/20 0.40
EGFR P00533 1/20 0.40
RET P07949 1/20 0.40
KIF5B P33176 1/20 0.40
KDR P35968 1/20 0.40
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
FBP1 P09467 2/20 0.39
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
DYRK1A Q13627 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL3821978 0.87 KCNH2 (0.57) NPC1RAB9AKCNH2EGFRGAA
SCHEMBL2635645 0.87 RAB9A (0.54) NPC1RAB9AKCNH2EGFRRET
SCHEMBL5803349 0.85 NPC1 (0.69) NPC1RAB9AC1RGAAMEN1
SCHEMBL1748245 0.85 NPC1 (0.45) NPC1RAB9AKCNH2C1REGFR
SCHEMBL11380542 0.79 NPC1 (0.73) NPC1RAB9AC1RGAAMEN1
SCHEMBL5550282 0.76 NPC1 (0.41) NPC1RAB9AKCNH2FAAHC1R
SCHEMBL25245167 0.74 NPC1 (0.54) NPC1RAB9AFAAHC1RGAA
SCHEMBL31430447 0.74 NPC1 (0.60) NPC1RAB9AC1RGAAMEN1
SCHEMBL30536878 0.73 NPC1 (0.56) NPC1RAB9AFAAHGAAMEN1
SCHEMBL26125848 0.73 NPC1 (0.56) NPC1RAB9AFAAHGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730148-A4 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LAB (US) 2009-08-19 EP disclosed
EP-1730148-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS Abbott Laboratories (US) 2006-12-13 EP disclosed
US-20060025383-A1 Aminobenzoxazoles as therapeutic agents ABBOTT LABORATORIES 2006-02-02 US disclosed
WO-2005074603-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LABORATORIES (US) 2005-08-18 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-20060025383-A1 Aminobenzoxazoles as therapeutic agents ABL1, MAP3K19, MAP3K20 NPC1 4475/4885RAB9A 2517/4885KCNH2 3160/4885

“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.