SCHEMBL5576642

SCHEMBL5576642

O=Cc1ccc(C(=O)NC2CCOCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.51
HDAC4 P56524 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
KDM4E B2RXH2 1/20 0.49
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM1A O60341 3/20 0.48
MEN1 O00255 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
GAA P10253 1/20 0.47
CYP1A2 P05177 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 1/20 0.44
BRD4 O60885 1/20 0.44

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
SCHEMBL1663048 0.89 RAB9A (0.59) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL22441291 0.87 NPC1 (0.60) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL23651430 0.84 NPC1 (0.66) RAB9ANPC1SMN1; SMN2KMT2ACYP1A2
SCHEMBL7450964 0.84 NPC1 (0.66) RAB9ANPC1SMN1; SMN2KMT2ACYP1A2
SCHEMBL15088518 0.82 NAMPT (0.54) NAMPTHDAC4HDAC6KDM4ERAB9A
SCHEMBL5497348 0.82 RAB9A (0.56) NAMPTHDAC4HDAC6KDM4ERAB9A
SCHEMBL30914509 0.81 NPC1 (0.71) NAMPTHDAC4HDAC6KDM4ERAB9A
SCHEMBL1560664 0.81 KDM1A (0.53) NAMPTHDAC4HDAC6KDM4ERAB9A
SCHEMBL12124399 0.81 HPGD (0.71) NAMPTHDAC4HDAC6KDM4ERAB9A
SCHEMBL4514709 0.81 CYP1A2 (0.53) NAMPTHDAC4HDAC6KDM4ERAB9A

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 NAMPT 2025/4885HDAC4 624/4885HDAC6 768/4885

“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.