SCHEMBL760516

SCHEMBL760516

O=C(Nc1ccccc1F)n1cc[c]n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.49
NPC1 O15118 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
KDM4E B2RXH2 1/20 0.45
TSHR P16473 1/20 0.43
CASP3 P42574 1/20 0.43
EPHB3 P54753 1/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FAAH O00519 1/20 0.40

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
SCHEMBL755622 0.84 NPC1 (0.44) RAB9ANPC1SMN1; SMN2TSHRKMT2A
SCHEMBL11032471 0.82 NPC1 (0.49) RAB9ANPC1SMN1; SMN2KMT2AALDH1A1
SCHEMBL11028201 0.82 MEN1 (0.52) RAB9ASMN1; SMN2KDM4ETSHREPHB3
SCHEMBL752278 0.77 MEN1 (0.49) RAB9ANPC1SMN1; SMN2KDM4EEPHB3
SCHEMBL6282323 0.76 POLB (0.52) RAB9ANPC1SMN1; SMN2KDM4ETSHR
SCHEMBL752990 0.72 MAPT (0.54) TSHRKMT2AHTTMEN1POLB
SCHEMBL11029424 0.70 RAB9A (0.46) RAB9ANPC1SMN1; SMN2KDM4ETSHR
SCHEMBL11027629 0.69 ALDH1A1 (0.52) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL30851501 0.67 RAB9A (1.00) RAB9ANPC1SMN1; SMN2KDM4EKMT2A
SCHEMBL6850971 0.67 RAB9A (0.75) RAB9ANPC1SMN1; SMN2KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP claimed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD RAB9A 677/4885NPC1 732/4885SMN1; SMN2 3999/4885

“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.