SCHEMBL3024174

SCHEMBL3024174

CCC1C(C)N2CCN1C(C(=O)OC)C2

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
FKBP1A P62942 2/20 0.33
PEPD P12955 1/20 0.33
MMP2 P08253 1/20 0.33
ANPEP P15144 1/20 0.33
BRD4 O60885 1/20 0.31
TP53 P04637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 2/20 0.30
MAPT P10636 2/20 0.30
CYP2C19 P33261 1/20 0.30
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL3015081 0.88 FKBP1A (0.33) GAAFKBP1APEPDMMP2ANPEP
SCHEMBL3022604 0.87 ALDH1A1 (0.34) GAAFKBP1AMAPTALDH1A1
SCHEMBL3016583 0.84 MMP2 (0.38) PEPDMMP2ANPEPBRD4TP53
SCHEMBL3016989 0.75 ALDH1A1 (0.34) GAAFKBP1ATP53MAPTALDH1A1
SCHEMBL3019979 0.73 ALDH1A1 (0.37) FKBP1AMAPTALDH1A1
SCHEMBL3013238 0.68 TSHR (0.39) PEPDMMP2ANPEPBRD4TP53
SCHEMBL3018094 0.67 TSHR (0.38) GAAMMP2ANPEPBRD4TP53
SCHEMBL25872909 0.65 FKBP1A (0.36) GAAFKBP1APEPDMMP2ANPEP
SCHEMBL3017696 0.64 MMP2 (0.41) GAAMMP2ANPEPBRD4TP53
SCHEMBL3019161 0.62 CHRM2 (0.31)

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
US-20100204438-A1 METHOD FOR PRODUCING TEDA DERIVATIVES BASF SE (DE) 2010-08-12 US disclosed
EP-2197882-A2 METHOD FOR PRODUCING TEDA DERIVATIVES Basf Se (DE) 2010-06-23 EP disclosed
WO-2009030649-A2 METHOD FOR PRODUCING TEDA DERIVATIVES BASF SE (DE) 2009-03-12 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-20100204438-A1 METHOD FOR PRODUCING TEDA DERIVATIVES TES, TRRAP, NAAA GAA 3017/4885FKBP1A 710/4885PEPD 819/4885

“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.