SCHEMBL4244426

SCHEMBL4244426

CC(C)(C)OC(=O)N1CCC(C)(C(=O)c2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
GPR119 Q8TDV5 7/20 0.48
TACR1 P25103 1/20 0.47
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HDAC4 P56524 2/20 0.43
P2RY14 Q15391 1/20 0.42
STS P08842 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
RORC P51449 3/20 0.41

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
SCHEMBL25206278 0.87 MAPT (0.49) MAPTGPR119TACR1KMT2AMEN1
SCHEMBL5671917 0.87 HDAC2 (0.49) MAPTGPR119KMT2AMEN1RORC
SCHEMBL18321714 0.85 RORC (0.46) MAPTGPR119KMT2AMEN1RORC
SCHEMBL17848693 0.84 KDM4E (0.51) MAPTGPR119TACR1KMT2AMEN1
SCHEMBL15566425 0.80 MEN1 (0.65) MAPTGPR119KMT2AMEN1HDAC4
SCHEMBL6795066 0.80 MAPT (0.55) MAPTGPR119TACR1STSRORC
SCHEMBL25421346 0.80 RORC (0.42) MAPTKMT2AMEN1RORC
SCHEMBL31708088 0.80 RORC (0.42) MAPTGPR119KMT2AMEN1RORC
SCHEMBL18282923 0.79 CES2 (0.53) KMT2AMEN1HPGDTSHR
SCHEMBL31708135 0.79 RORC (0.43) MAPTKMT2AMEN1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491735-B2 Chemokine receptor binding compounds GENZYME CORPORATION (US) 2009-02-17 US disclosed
EP-1708703-A4 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC (CA) 2008-04-09 EP disclosed
EP-1708703-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2006-10-11 EP disclosed
US-20050277670-A1 Chemokine receptor binding compounds ANORMED INC. 2005-12-15 US disclosed
WO-2005059107-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2005-06-30 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-20050277670-A1 Chemokine receptor binding compounds CCR5, CXCR3, CCL5 MAPT 3843/4885GPR119 207/4885TACR1 35/4885

“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.