SCHEMBL5895648

SCHEMBL5895648

CCC(O)CC(=O)C1(OC)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TACR1 P25103 1/20 0.38
TSHR P16473 2/20 0.37
DPP4 P27487 1/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
ALOX15 P16050 1/20 0.35
ATM Q13315 1/20 0.35
GPR119 Q8TDV5 2/20 0.35
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.35
EED O75530 1/20 0.35
RBBP4 Q09028 1/20 0.35
SUZ12 Q15022 1/20 0.35
EZH2 Q15910 1/20 0.35
AEBP2 Q6ZN18 1/20 0.35

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
SCHEMBL5896049 0.78 USP2 (0.42) USP2SMN1; SMN2TSHRDDB1CRBN
SCHEMBL19216685 0.76 USP2 (0.40) USP2SMN1; SMN2TSHRDDB1CRBN
SCHEMBL1146902 0.75 USP2 (0.50) USP2SMN1; SMN2TSHRALOX15ATM
SCHEMBL5896855 0.75 USP2 (0.50) USP2SMN1; SMN2TSHRALOX15ATM
SCHEMBL19216686 0.75 SMN1; SMN2 (0.44) USP2SMN1; SMN2TSHRALOX15HPGD
SCHEMBL5896147 0.74 USP2 (0.49) USP2SMN1; SMN2TSHRALOX15ATM
SCHEMBL23138085 0.74 USP2 (0.40) USP2SMN1; SMN2TSHRDPP4GPR119
SCHEMBL2943334 0.73 USP2 (0.47) USP2SMN1; SMN2TACR1TSHRDDB1
SCHEMBL10172533 0.72 USP2 (0.50) USP2SMN1; SMN2TACR1TSHRDPP4
SCHEMBL29101928 0.72 ABCB1 (0.52) USP2SMN1; SMN2DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091211-B2 Cyclopentyl modulators of chemokine receptor activity MERCK & CO., INC. (US) 2006-08-15 US disclosed
US-20050070609-A1 Cyclopentyl modulators of chemokine receptor activity MERCK SHARP & DOHME CORP. 2005-03-31 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-20050070609-A1 Cyclopentyl modulators of chemokine receptor activity CCR5, CXCR1, ACKR3 USP2 4590/4885SMN1; SMN2 4725/4885TACR1 40/4885

“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.