SCHEMBL9954367

SCHEMBL9954367

Cc1c(-c2ccccc2)nc2ncccc2c1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.63
TOP1 P11387 1/20 0.48
KMT2A Q03164 2/20 0.43
ABCG2 Q9UNQ0 2/20 0.42
TSHR P16473 1/20 0.42
PDE10A Q9Y233 1/20 0.42
KDM4E B2RXH2 2/20 0.40
PIK3CA P42336 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
BACE1 P56817 1/20 0.40
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NQO2 P16083 1/20 0.39

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
SCHEMBL30354673 0.85 DHODH (0.52) DHODHKMT2AABCG2MEN1L3MBTL1
SCHEMBL2124987 0.83 DHODH (0.62) DHODHTOP1KMT2AABCG2TSHR
SCHEMBL6509749 0.80 DHODH (0.94) DHODHTSHRPDE10A
SCHEMBL9953444 0.79 DHODH (0.48) DHODHKMT2AABCG2MEN1L3MBTL1
SCHEMBL9953191 0.78 DHODH (0.47) DHODHKMT2AABCG2KDM4EMEN1
SCHEMBL13758058 0.78 PDE10A (0.60) DHODHTOP1TSHRPDE10AMAPT
SCHEMBL12522176 0.77 DHODH (0.55) DHODHKMT2AABCG2KDM4EALDH1A1
SCHEMBL6509265 0.76 DHODH (0.72) DHODHKMT2ATSHRPDE10AMEN1
SCHEMBL28159695 0.72 TDP1 (0.66) DHODHTOP1TSHRPDE10AKDM4E
SCHEMBL10205867 0.71 KDM4E (0.50) DHODHTOP1KMT2ATSHRPDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2013-10-30 EP disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
US-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN, INC. (CA) 2013-10-10 US disclosed
WO-2012087784-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-06-28 WO disclosed
WO-2012087784-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-06-28 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-20130267526-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 DHODH 2700/4885TOP1 715/4885KMT2A 729/4885

“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.