SCHEMBL11028201

SCHEMBL11028201

O=C(Nc1ccccc1C(F)(F)F)n1cc[c]n1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TP53 P04637 3/20 0.47
KDM4E B2RXH2 3/20 0.46
GAA P10253 2/20 0.46
EPHB3 P54753 1/20 0.45
RAB9A P51151 1/20 0.45
POLB P06746 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 1/20 0.43
TRPV1 Q8NER1 2/20 0.42

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
SCHEMBL760516 0.82 RAB9A (0.49) MEN1KMT2AKDM4EEPHB3RAB9A
SCHEMBL11032471 0.79 NPC1 (0.49) KMT2ARAB9APOLBSMN1; SMN2MAPT
SCHEMBL752278 0.74 MEN1 (0.49) MEN1KMT2AKDM4EEPHB3RAB9A
SCHEMBL755622 0.72 NPC1 (0.44) MEN1KMT2ATP53RAB9APOLB
SCHEMBL752990 0.69 MAPT (0.54) MEN1KMT2ATP53POLBMAPT
SCHEMBL5427163 0.69 MEN1 (0.74) MEN1KMT2ATP53KDM4EGAA
SCHEMBL3938038 0.69 POLB (0.58) MEN1KMT2AKDM4EGAARAB9A
SCHEMBL2092532 0.69 POLB (0.58) MEN1KMT2AKDM4EGAARAB9A
SCHEMBL1008398 0.69 POLB (0.63) MEN1KMT2AKDM4EGAAPOLB
SCHEMBL29958946 0.69 GRIN2D (0.60) MEN1KMT2AKDM4EGAARAB9A

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-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-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

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 MEN1 2197/4885KMT2A 2120/4885TP53 558/4885

“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.