SCHEMBL4597612

SCHEMBL4597612

Cc1cccc([C@@H]2COC(=O)N2C2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.52
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
USP30 Q70CQ3 1/20 0.41
STS P08842 1/20 0.41
KDM4E B2RXH2 1/20 0.40
THRB P10828 1/20 0.40
EPHX2 P34913 1/20 0.40
GRM5 P41594 1/20 0.40

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
SCHEMBL5576090 1.00 GPR119 (0.52) GPR119HDAC1HDAC6TP53MAPT
SCHEMBL5575539 0.89 STS (0.48) GPR119HDAC1HDAC6TP53MAPT
SCHEMBL5575543 0.89 STS (0.48) GPR119HDAC1HDAC6TP53MAPT
SCHEMBL5576103 0.89 GPR119 (0.50) GPR119TP53MAPTKMT2AMEN1
SCHEMBL6503899 0.89 GPR119 (0.50) GPR119TP53MAPTKMT2AMEN1
SCHEMBL4598582 0.89 GPR119 (0.50) GPR119TP53MAPTKMT2AMEN1
SCHEMBL5576017 0.83 GPR119 (0.53) GPR119HDAC1HDAC6TP53MAPT
SCHEMBL5576012 0.83 GPR119 (0.53) GPR119HDAC1HDAC6TP53MAPT
SCHEMBL4598129 0.81 GPR119 (0.45) GPR119TP53MAPTSTSKDM4E
SCHEMBL4596126 0.81 GPR119 (0.45) GPR119TP53MAPTSTSKDM4E

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 GPR119 229/4885HDAC1 958/4885HDAC6 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.