SCHEMBL1129268

SCHEMBL1129268

Cc1cc(Br)cc(Cl)c1Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
POLB P06746 2/20 0.39
RHEB Q15382 3/20 0.37
LTA4H P09960 2/20 0.37
NPBWR1 P48145 1/20 0.37
MCHR1 Q99705 1/20 0.37
TSHR P16473 1/20 0.37
TNK2 Q07912 2/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
STK39 Q9UEW8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GLA P06280 1/20 0.34
NQO2 P16083 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 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
SCHEMBL13556591 0.80 NPBWR1 (0.44) POLBRHEBLTA4HNPBWR1MCHR1
SCHEMBL1207327 0.76 ALDH1A1 (0.56) ALDH1A1POLBKMT2AMEN1MAPT
SCHEMBL11233429 0.74 RHEB (0.45) POLBRHEBLTA4HNPBWR1MCHR1
SCHEMBL931631 0.74 POLB (0.44) ALDH1A1POLBKMT2AMEN1MAPT
SCHEMBL23663156 0.73 NPBWR1 (0.48) ALDH1A1LTA4HNPBWR1MCHR1KMT2A
SCHEMBL8737314 0.72 NPBWR1 (0.40) POLBRHEBLTA4HNPBWR1MCHR1
SCHEMBL8803991 0.72 MAOB (0.41) ALDH1A1POLBKMT2AMEN1SMN1; SMN2
SCHEMBL5529876 0.71 LTA4H (0.48) ALDH1A1RHEBLTA4HTSHRKMT2A
SCHEMBL11583506 0.71 LTA4H (0.48) ALDH1A1LTA4HTSHRKMT2AMEN1
SCHEMBL1129409 0.71 LIPG (0.43) POLBRHEBNPBWR1MCHR1TNK2

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
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
EP-2283020-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009143051-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 ALDH1A1 292/4885POLB 3878/4885RHEB 2622/4885

“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.