SCHEMBL5576571

SCHEMBL5576571

NC(CNC1CCOCC1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCDIN3D Q7Z5W3 2/20 0.47
KDM4E B2RXH2 1/20 0.42
GBA1 P04062 1/20 0.41
SOS1 Q07889 1/20 0.39
OPRL1 P41146 2/20 0.38
GRIN2B Q13224 1/20 0.36
CSF1R P07333 1/20 0.36

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
SCHEMBL18539370 1.00 BCDIN3D (0.47) BCDIN3DKDM4EGBA1SOS1OPRL1
SCHEMBL3757143 1.00 BCDIN3D (0.47) BCDIN3DKDM4EGBA1SOS1OPRL1
SCHEMBL5575374 0.83 KDM4E (0.59) KDM4ESOS1
SCHEMBL9350980 0.83 KDM4E (0.59) KDM4ESOS1
SCHEMBL18539369 0.81 KDM4E (0.43) BCDIN3DKDM4ESOS1OPRL1GRIN2B
SCHEMBL13946612 0.78 KCNH3 (0.42) BCDIN3DGBA1CSF1R
SCHEMBL3753180 0.78 KCNH3 (0.42) BCDIN3DGBA1CSF1R
SCHEMBL18539306 0.78 ADRB2 (0.46) BCDIN3DKDM4E
SCHEMBL3639265 0.75 SOS1 (0.67) KDM4ESOS1OPRL1
SCHEMBL4689291 0.74 GRIN2B (0.43) GRIN2B

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 BCDIN3D 1624/4885KDM4E 3689/4885GBA1 3249/4885

“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.