SCHEMBL4240682

SCHEMBL4240682

CCCCN1CCC(OC2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 8/20 0.44
KCNH2 Q12809 1/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PMP22 Q01453 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
EPHX1 P07099 1/20 0.39
EPHX2 P34913 1/20 0.39
GNAI3 P08754 2/20 0.39
GNAO1 P09471 2/20 0.39
GNAI1 P63096 2/20 0.39

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
SCHEMBL23133951 0.88 CHRM3 (0.42) CHRM3KCNH2KDM4EALDH1A1EPHX1
SCHEMBL3316196 0.85 GNAI3 (0.53) CHRM3KCNH2KDM4EALDH1A1PMP22
SCHEMBL1048005 0.79 GPR183 (0.47) CHRM3KCNH2KDM4EALDH1A1GNAI3
SCHEMBL23134625 0.78 CHRM3 (0.40) CHRM3KDM4EALDH1A1EPHX1EPHX2
SCHEMBL27097566 0.76 GNAO1 (0.42) CHRM3EPHX1EPHX2GNAI3GNAO1
SCHEMBL4236368 0.76 GNAO1 (0.57) CHRM3GNAI3GNAO1GNAI1
SCHEMBL27097459 0.76 GNAO1 (0.42) CHRM3EPHX1EPHX2GNAI3GNAO1
SCHEMBL5212568 0.76 SMN1; SMN2 (0.41)
SCHEMBL5270128 0.76 LIPC (0.42) KDM4EALDH1A1EPHX2GNAI3GNAO1
SCHEMBL27762899 0.74 CHRM3 (0.49) CHRM3KCNH2EPHX1EPHX2GNAI3

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US claimed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R CHRM3 168/4885KCNH2 1304/4885KDM4E 1604/4885

“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.