SCHEMBL4193569

SCHEMBL4193569

CC(=O)Nc1ccc(O)cc1OC[C@]1(C)CO1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.44
CCR1 P32246 6/20 0.44
BRD4 O60885 11/20 0.43
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL4185400 1.00 CYP19A1 (0.44) CYP19A1CCR1BRD4NPC1POLB
SCHEMBL4190413 0.90 CCR1 (0.42) CYP19A1CCR1BRD4NPC1MAPT
SCHEMBL4343117 0.90 CCR1 (0.42) CYP19A1CCR1BRD4NPC1MAPT
SCHEMBL4190419 0.90 CCR1 (0.42) CYP19A1CCR1BRD4NPC1MAPT
SCHEMBL6211946 0.85 CCR1 (0.47) CYP19A1CCR1BRD4NPC1POLB
SCHEMBL4216929 0.84 ALDH1A1 (0.51) CCR1NPC1POLBMAPTRAB9A
SCHEMBL4216922 0.84 ALDH1A1 (0.51) CCR1NPC1POLBMAPTRAB9A
SCHEMBL3201062 0.83 KDM4E (0.45) CYP19A1CCR1BRD4NPC1POLB
SCHEMBL6214263 0.82 BRD4 (0.58) BRD4NPC1POLBMAPTRAB9A
SCHEMBL3807614 0.82 BRD4 (0.58) BRD4NPC1POLBMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064884-A1 Novel Process 1 ASTRAZENECA AB (SE) 2008-03-13 US claimed
EP-2027105-A2 NOVEL PROCESS FOR PREPARING INTERMEDIATES OF CCR ANTAGONISTS AstraZeneca AB (SE) 2009-02-25 EP disclosed
US-20080064884-A1 Novel Process 1 ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064884-A1 Novel Process 1 ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064884-A1 Novel Process 1 ASTRAZENECA AB (SE) 2008-03-13 US disclosed
WO-2007129960-A2 NOVEL PROCESSES FOR PREPARING INTERMEDIATES OF CCR ANTAGONISTS ASTRAZENECA AB (SE) 2007-11-15 WO 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-20080064884-A1 Novel Process 1 TPX2, UGT1A1, BRIX1 CYP19A1 249/4885CCR1 258/4885BRD4 2423/4885

“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.