SCHEMBL4518525

SCHEMBL4518525

Clc1ccc(Nc2ccc(-c3nnc4ccccn34)cn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.64
KMT2A Q03164 4/20 0.64
HSD17B10 Q99714 2/20 0.64
MEN1 O00255 2/20 0.43
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CDK2 P24941 1/20 0.42
MAPT P10636 3/20 0.41
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
GRM5 P41594 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
GSK3B P49841 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
BRAF P15056 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL7698163 0.77 KDM4E (0.67) KDM4EKMT2AHSD17B10MEN1MAPK1
SCHEMBL4519722 0.73 KDR (0.45) KDM4EKMT2AHSD17B10MEN1MAPK1
SCHEMBL29564868 0.73 KDM4E (0.55) KDM4EKMT2AHSD17B10MEN1MAPK1
SCHEMBL4515632 0.72 GRM5 (0.43) KMT2AALDH1A1MAPTGRM5NPC1
SCHEMBL22627395 0.71 NR1I3 (0.45) KDM4ECDK2SMN1; SMN2NPC1RAB9A
SCHEMBL4524435 0.71 LIMK2 (0.50) KDM4EKMT2AHSD17B10MEN1MAPK1
SCHEMBL4522322 0.70 GRM5 (0.40) CDK2MAPTGRM5NPC1RAB9A
SCHEMBL4511986 0.70 HPGD (0.64) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL4528975 0.69 GRM5 (0.44) MAPTGRM5SMN1; SMN2NPC1RAB9A
SCHEMBL29501822 0.68 MAPT (0.57) MAPTGRM5

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
US-20090286827-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2009-11-19 US disclosed
US-20090286827-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2009-11-19 US disclosed
US-20090286827-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2009-11-19 US disclosed
WO-2007113276-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2007-10-11 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-20090286827-A1 NOVEL BI-ARYL AMINES NAT1, MAOB, CYP2B6 KDM4E 2428/4885KMT2A 2114/4885HSD17B10 1121/4885

“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.