SCHEMBL25314520

SCHEMBL25314520

Cc1cc(Br)cc2nc(C#N)ccc12

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.44
NQO1 P15559 1/20 0.41
F2 P00734 3/20 0.39
TSHR P16473 1/20 0.39
HBB P68871 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.38
NOS1 P29475 5/20 0.37
NOS3 P29474 4/20 0.37
MPO P05164 1/20 0.37
PDE10A Q9Y233 1/20 0.35
BACE1 P56817 1/20 0.35
MDM4 O15151 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
SCHEMBL11986214 0.79 NQO1 (0.41) NQO1TSHRHBBHSD17B10L3MBTL1
SCHEMBL18564070 0.77 POLB (0.52) NQO2F2POLBMPOBACE1
SCHEMBL11986212 0.76 NQO1 (0.44) NQO2NQO1TSHRHBBHSD17B10
SCHEMBL8745764 0.75 NQO1 (0.42) NQO1POLB
SCHEMBL15448467 0.74 NQO2 (0.47) NQO2F2TSHRHSD17B10POLB
SCHEMBL15448466 0.74 POLB (0.49) NQO2F2HSD17B10POLBMPO
SCHEMBL27185303 0.72 F2 (0.47) NQO2F2HSD17B10POLBNOS1
SCHEMBL11986218 0.72 NQO1 (0.41) NQO1TSHRHBBHSD17B10L3MBTL1
SCHEMBL11986229 0.72 NQO1 (0.41) NQO1TSHRHBBHSD17B10L3MBTL1
SCHEMBL23619822 0.71 CYP1A2 (0.51) NQO2F2TSHRHBBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084062-A1 SUBSTITUTED QUINOLINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2025-03-13 US disclosed
CN-118488952-A Substituted quinoline derivatives 安斯泰来制药有限公司 2024-08-13 CN disclosed
WO-2023127814-A1 SUBSTITUTED QUINOLINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2023-07-06 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-20250084062-A1 SUBSTITUTED QUINOLINE DERIVATIVE CHRNA4, CHRNA2, CHRNA5 NQO2 54/4885NQO1 416/4885F2 4783/4885

“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.