SCHEMBL3016583

SCHEMBL3016583

COC(=O)C1CN2CCN1C(C)C2C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.38
ANPEP P15144 3/20 0.38
CYP2C19 P33261 1/20 0.35
TSHR P16473 1/20 0.34
POLB P06746 1/20 0.33
BRD4 O60885 1/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 1/20 0.32
PEPD P12955 1/20 0.31

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 0.84 FKBP1A (0.33) MMP2ANPEPCYP2C19BRD4TP53
SCHEMBL3024174 0.84 GAA (0.33) MMP2ANPEPCYP2C19BRD4TP53
SCHEMBL3019979 0.81 ALDH1A1 (0.37) POLBALDH1A1KMT2A
SCHEMBL3013238 0.76 TSHR (0.39) MMP2ANPEPCYP2C19TSHRPOLB
SCHEMBL3020560 0.75 CHRM2 (0.38) ALDH1A1
SCHEMBL3018094 0.74 TSHR (0.38) MMP2ANPEPTSHRPOLBBRD4
SCHEMBL3017696 0.71 MMP2 (0.41) MMP2ANPEPCYP2C19POLBBRD4
SCHEMBL3016989 0.69 ALDH1A1 (0.34) POLBTP53ALDH1A1KMT2A
SCHEMBL3022604 0.69 ALDH1A1 (0.34) TSHRPOLBALDH1A1KMT2A
SCHEMBL3010100 0.69 CHRM2 (0.36) CYP2C19POLBKMT2A

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 MMP2 3185/4885ANPEP 3214/4885CYP2C19 1659/4885

“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.