SCHEMBL2126776

SCHEMBL2126776

Cc1c(-c2ccccc2F)nc2ccccc2c1F

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.55
MBNL1 Q9NR56 1/20 0.55
KMT2A Q03164 2/20 0.46
C1R P00736 1/20 0.45
DHODH Q02127 8/20 0.45
DHFR P00374 1/20 0.43
ALKBH5 Q6P6C2 1/20 0.43
MAPT P10636 1/20 0.43
TACR3 P29371 1/20 0.42
MEN1 O00255 1/20 0.42
GBA1 P04062 1/20 0.42
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 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
SCHEMBL13063652 0.88 ADORA2A (0.57) ADORA2AMBNL1KMT2AC1RDHODH
SCHEMBL2123544 0.84 ADORA2A (0.53) ADORA2AMBNL1KMT2AC1RDHODH
SCHEMBL2123690 0.84 ADORA2A (0.53) ADORA2AMBNL1KMT2AC1RDHODH
SCHEMBL2123351 0.79 ALOX5AP (0.45) KMT2ADHODHPIK3CA
SCHEMBL27883214 0.79 KMT2A (0.40) ADORA2AMBNL1KMT2ADHODHMAPT
SCHEMBL1758144 0.77 ADORA2A (0.55) ADORA2AMBNL1KMT2AC1RMAPT
SCHEMBL13063627 0.77 MBNL1 (0.55) ADORA2AMBNL1DHODHMAPTPIK3CA
SCHEMBL1758166 0.77 ADORA2A (0.55) ADORA2AMBNL1KMT2AC1RDHODH
SCHEMBL13063898 0.77 MBNL1 (0.55) ADORA2AMBNL1DHODHDHFRALKBH5
SCHEMBL27866881 0.76 HSD11B1 (0.49) KMT2ADHODHMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 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-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 ADORA2A 1268/4885MBNL1 1806/4885KMT2A 679/4885

“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.