SCHEMBL4625809

SCHEMBL4625809

CC(C)(C)OC(=O)N1CCC(N2C(=O)N(C3(C)CC3)CC2c2cccc(Cl)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STS P08842 2/20 0.45
TP53 P04637 4/20 0.43
MAPT P10636 3/20 0.43
USP30 Q70CQ3 1/20 0.42
KDM4E B2RXH2 1/20 0.41
THRB P10828 1/20 0.41
TNF P01375 3/20 0.40
LITAF Q99732 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
GPR119 Q8TDV5 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
SCHEMBL5572456 0.85 STS (0.48) STSTP53MAPTUSP30KDM4E
SCHEMBL5576084 0.83 CCR5 (0.54) STSTP53MAPT
SCHEMBL5576089 0.83 CCR5 (0.54) STSTP53MAPT
SCHEMBL4608051 0.82 CCR5 (0.46) STSTP53MAPTUSP30KDM4E
SCHEMBL4597776 0.81 TP53 (0.47) STSTP53MAPTUSP30KDM4E
SCHEMBL5575923 0.81 ALDH1A1 (0.37) TP53MAPTTHRB
SCHEMBL5572449 0.81 CCR5 (0.47) STSTP53MAPTUSP30KDM4E
SCHEMBL4595920 0.81 STS (0.44) STSTP53MAPTKDM4ETHRB
SCHEMBL5572451 0.80 STS (0.43) STSTP53MAPTUSP30KDM4E
SCHEMBL5573793 0.80 SMN1; SMN2 (0.44) STSTP53MAPTUSP30KDM4E

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
EP-1924265-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS Genzyme Corporation (US) 2008-05-28 EP disclosed
US-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 US disclosed
WO-2007022371-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2007-02-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 STS 4841/4885TP53 2854/4885MAPT 3432/4885

“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.