SCHEMBL18172279

SCHEMBL18172279

CC(O)CNc1ncc(Br)cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CFTR P13569 2/20 0.38
GAA P10253 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
CHEK1 O14757 1/20 0.35
CDK1 P06493 1/20 0.35
P2RX3 P56373 2/20 0.35
P2RX2 Q9UBL9 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.34
CYP2C9 P11712 2/20 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
SCHEMBL20061678 1.00 MAPT (0.41) MAPTALDH1A1KDM4ESMN1; SMN2CFTR
SCHEMBL15649492 0.78 KMT2A (0.39) MAPTALDH1A1KDM4EGAANPSR1
SCHEMBL18172316 0.76 MAPT (0.52) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL20061677 0.76 MAPT (0.52) MAPTALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL7885980 0.76 MAPT (0.45) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL16722341 0.75 KDR (0.40) MAPTALDH1A1CDK1P2RX3P2RX2
SCHEMBL16722344 0.75 KDR (0.40) MAPTALDH1A1CDK1P2RX3P2RX2
SCHEMBL789781 0.75 HTT (0.42) MAPTALDH1A1KDM4ESMN1; SMN2CHEK1
SCHEMBL1619871 0.72 KMT2A (0.43) MAPTALDH1A1KDM4ESMN1; SMN2CHEK1
SCHEMBL906615 0.72 CYP1A2 (0.41) ALDH1A1KDM4EP2RX3P2RX2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286188-B1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES CELLCENTRIC LTD (GB) 2019-03-20 EP disclosed
US-20180105519-A1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES CELLCENTRIC LTD (GB) 2018-04-19 US disclosed
EP-3286188-A1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES Cellcentric Ltd (GB) 2018-02-28 EP disclosed
WO-2016170323-A1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES CELLCENTRIC LTD (GB) 2016-10-27 WO disclosed
WO-2016170323-A1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES CELLCENTRIC LTD (GB) 2016-10-27 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-20180105519-A1 ISOXAZOLYL SUBSTITUTED IMIDAZOPYRIDINES EP300, HDAC3, HDAC1 MAPT 4493/4885ALDH1A1 886/4885KDM4E 341/4885

“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.