SCHEMBL5664853

SCHEMBL5664853

C=CCOC[C@@H]1CCCN(C[C@H]2CCCC[C@@H]2NC(=O)c2ccc(-n3cccn3)nc2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 11/20 0.44
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ CXCR4 P61073 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL14392673 1.00 CCR3 (0.44) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL4553255 1.00 CCR3 (0.44) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL4553257 1.00 CCR3 (0.44) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL14368833 1.00 CCR3 (0.44) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL14368838 0.90 CCR3 (0.46) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL5662103 0.90 CXCR4 (0.41) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL5662148 0.90 CXCR4 (0.41) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL14368937 0.90 CCR3 (0.46) CCR3CYP2D6
SCHEMBL14368834 0.90 CCR3 (0.47) CCR3MEN1KMT2ACYP1A2CYP2C19
SCHEMBL14392663 0.90 CCR3 (0.47) CCR3MEN1KMT2ACYP1A2CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US claimed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US disclosed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — 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-20070259888-A1 Novel Compounds OPRL1, OPRM1, SIGMAR1 CCR3 247/4885MEN1 2497/4885KMT2A 3736/4885

“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.

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