SCHEMBL11971209

SCHEMBL11971209

Cn1ncc(-c2cn(NC(=O)O)cn2)c1Br

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
APOBEC3A P31941 1/20 0.36
PDE10A Q9Y233 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM2B Q8NHM5 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTT P42858 1/20 0.30
CREBBP Q92793 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL11971099 0.76 KDM4E (0.33) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11971170 0.72 LRRK2 (0.30)
SCHEMBL2690083 0.69 POLB (0.35) KDM4EPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL27243496 0.68 MAPK1 (0.38) KDM4EALDH1A1POLBGAASMN1; SMN2
SCHEMBL16003588 0.61 PDE10A (0.45) KDM4EALDH1A1GAAPDE10AMEN1
SCHEMBL826742 0.60 SMN1; SMN2 (0.41) KDM4EALDH1A1POLBSMN1; SMN2NPC1
SCHEMBL11971165 0.60 BRD4 (0.33)
SCHEMBL16561204 0.60 PDE10A (0.44) KDM4EALDH1A1PDE10ASMN1; SMN2MEN1
SCHEMBL12990152 0.59 NPC1 (0.42) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL16003611 0.59 ALDH1A1 (0.38) KDM4EALDH1A1POLBGAAAPOBEC3A

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-8598155-B2 Imidazo[5,1-f][1,2,4]triazines for the treatment of neurological disorders PFIZER INC. (US) 2013-12-03 US disclosed
US-20120214791-A1 Imidazo[5,1-f][1,2,4]Triazines for the Treatment of Neurological Disorders PFIZER INC. 2012-08-23 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-20120214791-A1 Imidazo[5,1-f][1,2,4]Triazines for the Treatment of Neurological Disorders GRIK5, GRIN2C, BDNF KDM4E 3588/4885ALDH1A1 545/4885POLB 2677/4885

“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.