SCHEMBL1990306

SCHEMBL1990306

CC(c1nc2cccnc2cc1-c1ccccc1)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 3/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
ACVR1 Q04771 2/20 0.36
PDE10A Q9Y233 1/20 0.35
TGFBR1 P36897 2/20 0.35
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DHODH Q02127 1/20 0.34

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
SCHEMBL17718343 0.80 LMNA (0.37) LMNAHTTTDP1POLBKMT2A
SCHEMBL1989669 0.78 TOP1 (0.44) TOP1ALDH1A1HTTPDE10APOLB
SCHEMBL1990781 0.78 TOP1 (0.44) TOP1ALDH1A1PDE10A
SCHEMBL1993391 0.74 USP2 (0.39) ALDH1A1HSD17B10TGFBR1SMN1; SMN2DHODH
SCHEMBL12564510 0.74 CYP1A2 (0.36) ALDH1A1HSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL1994712 0.73 MBNL1 (0.40) LMNAALDH1A1TGFBR1SMN1; SMN2DHODH
SCHEMBL12974145 0.72 NT5E (0.38) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13370780 0.71 PIK3CD (0.55)
SCHEMBL28864685 0.70 MET (0.47) LMNAALDH1A1POLB
SCHEMBL17718398 0.70 AR (0.36) LMNAALDH1A1HTTHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633313-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-01-21 US disclosed
US-8633313-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-01-21 US disclosed
US-8633313-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-01-21 US disclosed
EP-2513109-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2012-10-24 EP disclosed
US-20110152296-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 US disclosed
WO-2011075628-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 WO disclosed
US-20110152296-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 US disclosed
WO-2011075628-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 WO disclosed
US-20110152296-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 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-20110152296-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 TOP1 701/4885LMNA 2309/4885ALDH1A1 3905/4885

“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.