SCHEMBL4467299

SCHEMBL4467299

COc1ccc(SC2CC3CCC(C2)N3)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
SLC6A4 P31645 5/20 0.45
SLC6A2 P23975 3/20 0.45
SLC6A3 Q01959 3/20 0.45
GRIN1 Q05586 2/20 0.41
GRIN2B Q13224 2/20 0.41
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
HTR4 Q13639 1/20 0.36
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL1186647 0.80 DDB1 (0.51) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL7947799 0.77 SLC6A4 (0.50) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL7947849 0.77 SLC6A2 (0.46) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL8442255 0.77 DDB1 (0.49) DDB1CRBNGRIN1GRIN2BCA12
SCHEMBL5635317 0.77 SLC6A4 (0.47) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL8428152 0.77 MAOA (0.50) DDB1CRBNGRIN1GRIN2BCA12
SCHEMBL12012244 0.76 SLC6A2 (0.42) CRBNSLC6A4SLC6A2SLC6A3MAOA
SCHEMBL8428605 0.76 TDP1 (0.50) DDB1CRBNCA12CA1CA2
SCHEMBL4475967 0.75 SLC6A3 (0.47) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL5635722 0.75 SLC6A3 (0.47) DDB1CRBNSLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494992-B2 Antiparasitic terpene alkaloids PFIZER INC. (US) 2009-02-24 US disclosed
US-20070185101-A1 Antiparasitic terpene alkaloids PFIZER PRODUCTS INC 2007-08-09 US disclosed
EP-1597264-A2 ANTIPARASITIC TERPENE ALKALOIDS Pfizer Limited (GB) 2005-11-23 EP disclosed
WO-2004072086-A2 ANTIPARASITIC TERPENE ALKALOIDS PFIZER LIMITED (GB) 2004-08-26 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-20070185101-A1 Antiparasitic terpene alkaloids CYP51A1, DHPS, CYP8B1 DDB1 3188/4885CRBN 4774/4885SLC6A4 2221/4885

“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.