SCHEMBL2152307

SCHEMBL2152307

CC(N)(C#N)C1Cc2cc(C#N)ccc2O1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 5/20 0.35
DPP4 P27487 4/20 0.35
KDM1A O60341 1/20 0.34
ACHE P22303 1/20 0.33
NPC1 O15118 1/20 0.33
ABCB1 P08183 3/20 0.32
PTGS2 P35354 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
SCHEMBL2152345 0.83 HRH4 (0.41) ACHENPC1
SCHEMBL2152350 0.83 PBRM1 (0.35) PNMTKDM1AACHENPC1
SCHEMBL31006601 0.82 PNMT (0.48) PNMTDPP4KDM1APTGS2
SCHEMBL2152425 0.80 SSTR4 (0.36)
SCHEMBL2152303 0.76 EZH2 (0.30)
SCHEMBL8688431 0.74 TDP1 (0.51) PNMTNPC1ABCB1
SCHEMBL8899294 0.71 PNMT (0.37) PNMTDPP4KDM1AABCB1PTGS2
SCHEMBL10440186 0.69 PNMT (0.33) PNMTABCB1PTGS2
SCHEMBL9358376 0.69 PNMT (0.36) PNMTDPP4KDM1AABCB1PTGS2
SCHEMBL2152471 0.69 POLB (0.45) ABCB1PTGS2

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
EP-2125766-B1 BENZOFURAN ANTIPARASITIC AGENTS PFIZER LTD (GB) 2011-07-06 EP disclosed
US-20100035980-A1 ANTIPARASITIC AGENTS PFIZER LIMITED (GB) 2010-02-11 US disclosed
US-7622500-B2 Antiparasitic agents PFIZER LIMITED (GB) 2009-11-24 US disclosed
US-20080200540-A1 ANTIPARASITIC AGENTS PFIZER LIMITED (GB) 2008-08-21 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 (2 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-20100035980-A1 ANTIPARASITIC AGENTS ACHE, MPO, ABCB11 PNMT 86/4885DPP4 699/4885KDM1A 4038/4885
US-20080200540-A1 ANTIPARASITIC AGENTS ACHE, MPO, ABCB11 PNMT 86/4885DPP4 699/4885KDM1A 4038/4885

“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.