SCHEMBL17242582

SCHEMBL17242582

O=c1[nH]c2c(F)cc(F)cc2c(=O)n1Cc1ccc(OC(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
GRIN1 Q05586 3/20 0.40
GRIN2B Q13224 3/20 0.40
TRAP1 Q12931 1/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ELANE P08246 2/20 0.37
RXFP1 Q9HBX9 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
DAO P14920 1/20 0.36
CPT1A P50416 1/20 0.36
CPT1B Q92523 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
IL6 P05231 1/20 0.35

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
SCHEMBL17242605 0.86 KDM4E (0.59) KDM4EKMT2AMEN1GRIN1GRIN2B
SCHEMBL17242533 0.84 DDR1 (0.46) KDM4EKMT2AMEN1TRAP1ELANE
SCHEMBL17242692 0.82 KDM4E (0.45) KDM4EKMT2AMEN1TRAP1ALDH1A1
SCHEMBL17242622 0.81 KDM4E (0.56) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL17242492 0.80 KDM4E (0.41) KDM4EKMT2AGRIN1GRIN2BTRAP1
SCHEMBL17242493 0.76 KDM4E (0.58) KDM4EKMT2AMEN1GRIN1GRIN2B
SCHEMBL17242559 0.76 KDM4E (0.52) KDM4EKMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL17242573 0.74 TRAP1 (0.48) KDM4EKMT2AMEN1TRAP1ALDH1A1
SCHEMBL17241558 0.72 P2RX3 (0.41) SMN1; SMN2MAPT
SCHEMBL17242545 0.72 KDM4E (0.59) KDM4EKMT2AMEN1GRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170137387-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES ORION CORPORATION (FI) 2017-05-18 US disclosed
EP-3140301-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES Orion Corporation (FI) 2017-03-15 EP disclosed
WO-2015169999-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES ORION CORPORATION (FI) 2015-11-12 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-20170137387-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES GABRB1, GABRB3, GABRB2 KDM4E 1998/4885KMT2A 2358/4885MEN1 3775/4885

“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.