SCHEMBL1881980

SCHEMBL1881980

Cc1noc(C)c1-c1nc2c(C)cccc2cc1CO

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PIK3CD O00329 2/20 0.39
BRD4 O60885 9/20 0.39
BRD2 P25440 5/20 0.39
CREBBP Q92793 3/20 0.39
RXFP1 Q9HBX9 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.37
CTSA P10619 2/20 0.36
BRD3 Q15059 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL1889253 0.87 BRD4 (0.39) MEN1KMT2APIK3CDBRD4BRD2
SCHEMBL1881999 0.79 MEN1 (0.46) MEN1KMT2APIK3CDATMDRD4
SCHEMBL1883185 0.78 ACACB (0.44) PIK3CDBRD4RXFP1CTSA
SCHEMBL1884046 0.77 ERN1 (0.49) BRD4BRD2CREBBPNPC1POLB
SCHEMBL1878147 0.76 PIK3CD (0.39) PIK3CDBRD4BRD2CREBBPPOLB
SCHEMBL1887862 0.75 MEN1 (0.48) MEN1KMT2APIK3CDATMDRD4
SCHEMBL1887556 0.75 PIK3CD (0.53) MEN1KMT2APIK3CDATMDRD4
SCHEMBL1879223 0.74 MEN1 (0.47) MEN1KMT2APIK3CDNPC1POLB
SCHEMBL1886286 0.73 PIK3CD (0.54) MEN1KMT2APIK3CDRAB9AATM
SCHEMBL1883935 0.72 PIK3CD (0.60) MEN1KMT2APIK3CDBRD4

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-8399483-B2 Quinoxaline and quinoline derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2013-03-19 US disclosed
US-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA, S.A. (BE) 2011-05-05 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-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS PDXK, PDPK1, PIKFYVE MEN1 1813/4885KMT2A 1617/4885PIK3CD 8/4885

“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.