SCHEMBL26638142

SCHEMBL26638142

Nc1nc(-c2cncc(F)c2)nc2ccoc12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.35
ADORA2B P29275 1/20 0.35
CYP11B1 P15538 5/20 0.33
CYP11B2 P19099 5/20 0.33
KDM4C Q9H3R0 1/20 0.33
CYP19A1 P11511 1/20 0.33
ADRA2B P18089 1/20 0.33
CYP17A1 P05093 1/20 0.32
CYP3A4 P08684 1/20 0.32
DPP4 P27487 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
TLR7 Q9NYK1 1/20 0.30
DYRK1A Q13627 1/20 0.30
PIK3CG P48736 1/20 0.30
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP1B1 Q16678 1/20 0.30
ABCG2 Q9UNQ0 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
SCHEMBL30493780 1.00 NQO2 (0.35) NQO2ADORA2BCYP11B1CYP11B2KDM4C
SCHEMBL30493771 0.83 GBA1 (0.40) CYP11B1CYP11B2DPP4PIK3CDPIK3CA
SCHEMBL30493685 0.77 CYP1A2 (0.54) CYP3A4DPP4CYP1A1CYP1A2CYP1B1
SCHEMBL21754322 0.71 TLR7 (0.40) NQO2ADORA2BKDM4CCYP3A4PIK3CD
SCHEMBL23348864 0.71 HCAR2 (0.45) NQO2ADORA2BCYP11B1CYP11B2KDM4C
SCHEMBL21899404 0.69 TLR7 (0.40) TLR7
SCHEMBL24800004 0.68 NOTUM (0.49) NQO2ADORA2BCYP11B1CYP11B2CYP19A1
SCHEMBL3705558 0.66 DCPS (0.47) PIK3CDPIK3CACYP1A2
SCHEMBL24408180 0.66 CYP1A2 (0.44) CYP3A4CYP1A1CYP1A2CYP1B1ABCG2
SCHEMBL22690047 0.64 PDE10A (0.47) CYP19A1DYRK1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230355759-A1 POPULATIONS OF NATURAL KILLER CELLS COMPRISING A CLEAVAGE RESISTANT CD16 CELULARITY INC. (US) 2023-11-09 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-20230355759-A1 POPULATIONS OF NATURAL KILLER CELLS COMPRISING A CLEAVAGE RESISTANT CD16 PBK, KLKB1, PIGK NQO2 2125/4885ADORA2B 3724/4885CYP11B1 1694/4885

“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.