SCHEMBL3013238

SCHEMBL3013238

COC(=O)C1CN2CCN1CC2C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
MMP2 P08253 3/20 0.39
ANPEP P15144 3/20 0.39
POLB P06746 1/20 0.33
BRD4 O60885 1/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C19 P33261 1/20 0.32
PEPD P12955 1/20 0.32

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
SCHEMBL3017696 0.76 MMP2 (0.41) MMP2ANPEPPOLBBRD4TP53
SCHEMBL3016583 0.76 MMP2 (0.38) TSHRMMP2ANPEPPOLBBRD4
SCHEMBL3655318 0.74
SCHEMBL3011272 0.74 CHRM2 (0.39) ALDH1A1
SCHEMBL11249862 0.71
SCHEMBL9472426 0.69 POLB (0.43) MMP2ANPEPPOLBTP53ALDH1A1
SCHEMBL3015081 0.68 FKBP1A (0.33) MMP2ANPEPBRD4TP53ALDH1A1
SCHEMBL3024174 0.68 GAA (0.33) MMP2ANPEPBRD4TP53ALDH1A1
SCHEMBL3018094 0.68 TSHR (0.38) TSHRMMP2ANPEPPOLBBRD4
SCHEMBL10794700 0.68

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 TSHR 1216/4885MMP2 3185/4885ANPEP 3214/4885

“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.