SCHEMBL5090787

SCHEMBL5090787

O=C(O)NC(c1ccco1)c1cc(Cl)c2cccnc2c1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 11/20 0.82
KDM4E B2RXH2 5/20 0.77
NPC1 O15118 5/20 0.77
RAB9A P51151 4/20 0.77
POLB P06746 3/20 0.77
LMNA P02545 2/20 0.77
TDP1 Q9NUW8 2/20 0.77
MEN1 O00255 2/20 0.77
KMT2A Q03164 2/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
HSP90AA1 P07900 4/20 0.76
HTT P42858 2/20 0.76
USP2 O75604 1/20 0.76
TP53 P04637 1/20 0.76
ALOX15 P16050 1/20 0.76
TSHR P16473 1/20 0.76
BRAF P15056 1/20 0.69
MCL1 Q07820 1/20 0.69
L3MBTL1 Q9Y468 4/20 0.62
NCOA3 Q9Y6Q9 1/20 0.56

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
SCHEMBL2598296 0.90 ALOX12 (1.00) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL17223785 0.88 ALOX12 (0.81) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL609251 0.87 ALOX12 (1.00) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL17223781 0.86 KDM4E (1.00) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL1811278 0.85 ADAMTS5 (0.79) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL608085 0.85 KDM4E (0.79) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL5095826 0.85 NPC1 (0.83) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL13236170 0.85 MEN1 (0.76) ALOX12KDM4ENPC1RAB9APOLB
SCHEMBL5090799 0.84 ADAMTS5 (0.74) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL610979 0.84 HSP90AA1 (1.00) ALOX12KDM4ENPC1RAB9APOLB

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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof MMP8, MMP26, MMP9 ALOX12 594/4885KDM4E 4164/4885NPC1 2196/4885

“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.