SCHEMBL403348

SCHEMBL403348

COC(=O)c1cnc2ccc(Br)cc2c1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.66
HTT P42858 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.54
MALT1 Q9UDY8 2/20 0.52
MAPK1 P28482 1/20 0.50
RXFP1 Q9HBX9 5/20 0.48
GAA P10253 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NR4A2 P43354 1/20 0.48
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
AURKB Q96GD4 2/20 0.43
AURKA O14965 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL401916 0.85 MAPK1 (0.65) TSHRHTTMAPK1RXFP1GAA
SCHEMBL529214 0.84 HTT (0.63) TSHRHTTL3MBTL1MALT1MAPK1
SCHEMBL7490398 0.82 HTT (0.50) TSHRHTTL3MBTL1MALT1MAPK1
SCHEMBL17241522 0.82 HTT (0.50) TSHRHTTL3MBTL1MALT1MAPK1
SCHEMBL2725311 0.81 HTT (0.49) TSHRHTTMALT1MAPK1RXFP1
SCHEMBL10282056 0.81 HTT (0.49) TSHRHTTMALT1MAPK1RXFP1
SCHEMBL15191018 0.81 HTT (0.49) TSHRHTTMALT1MAPK1RXFP1
SCHEMBL20442235 0.80 NR4A2 (0.47) TSHRHTTL3MBTL1MALT1RXFP1
SCHEMBL22589603 0.80 TSHR (0.49) TSHRHTTL3MBTL1MALT1MAPK1
SCHEMBL10281894 0.80 HTT (0.51) TSHRHTTMALT1MAPK1RXFP1

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-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2012-03-15 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-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS FLT1, FLT4, VEGFA TSHR 2602/4885HTT 2485/4885L3MBTL1 4861/4885

“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.