SCHEMBL5575494

SCHEMBL5575494

Cc1nc(Sc2ccc([O])cc2)ccc1C=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
HAO1 Q9UJM8 1/20 0.30
NOTUM Q6P988 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
SCHEMBL4597190 0.83 HAO1 (0.44) MAPTALDH1A1HAO1
SCHEMBL4596513 0.81 MAOA (0.44) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL4596529 0.81 TYMS (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL4597157 0.78 ALDH1A1 (0.46) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL3805487 0.78 PTGIR (0.41) SMN1; SMN2TP53MAPTALDH1A1HPGD
SCHEMBL4596630 0.78 CYP26A1 (0.40) TP53ALDH1A1HPGDHTT
SCHEMBL4596641 0.77 MAPT (0.34) SMN1; SMN2TP53MAPTALDH1A1NOTUM
SCHEMBL4596971 0.75 CYP4F2 (0.41) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL4598185 0.75 NR4A1 (0.41) SMN1; SMN2TP53MAPTALDH1A1HPGD
SCHEMBL5573786 0.75 ABCG2 (0.37) TP53MAPTALDH1A1HPGD

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-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 NPC1 473/4885RAB9A 2707/4885SMN1; SMN2 4729/4885

“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.