SCHEMBL6764285

SCHEMBL6764285

CCCCN(CCOc1ccc(N)cn1)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
GAA P10253 1/20 0.37
CYP2D6 P10635 1/20 0.37
DRD3 P35462 1/20 0.37
SCN1A P35498 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
CHEK2 O96017 1/20 0.36
CA14 Q9ULX7 1/20 0.35
RAB9A P51151 4/20 0.34
POLB P06746 2/20 0.34
KDM4E B2RXH2 2/20 0.34
SSTR4 P31391 1/20 0.34
NPC1 O15118 3/20 0.33

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
SCHEMBL1027194 0.93 KDM4E (0.36) LMNACYP1A2CYP3A4CHRM2HTR1A
SCHEMBL4900712 0.90 KDM4E (0.36) CYP1A2CYP2D6SCN1ASCN2ASCN3A
SCHEMBL13408567 0.82 PDK2 (0.42) CHEK2RAB9APOLBKDM4ESSTR4
SCHEMBL3889926 0.77 MAPT (0.39) LMNACYP1A2CYP3A4CHRM2HTR1A
SCHEMBL1027137 0.76 SSTR4 (0.34) LMNACYP1A2CYP3A4CYP2D6SCN1A
SCHEMBL4890440 0.76 ADRB3 (0.40) LMNACYP1A2CYP3A4RAB9APOLB
SCHEMBL16682335 0.75 TDP1 (0.41) KCNH2RAB9APOLBKDM4ESSTR4
SCHEMBL3142415 0.74 MAPT (0.51) LMNACYP1A2CYP3A4CHRM2HTR1A
SCHEMBL21554108 0.74 PDE3B (0.33) CHEK2CA14SSTR4
SCHEMBL3334395 0.74 KDM4E (0.53) LMNACYP1A2CYP3A4GAACYP2D6

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-20040220253-A1 Synthesis of pyrrole amides PFIZER INC. 2004-11-04 US disclosed
EP-1339681-A1 SYNTHESIS OF FUSED PYRROLECARBOXAMIDES Pfizer Products Inc. (US) 2003-09-03 EP disclosed
US-20020151718-A1 Synthesis of pyrrole amides PFIZER INC. 2002-10-17 US disclosed
WO-2002046155-A1 SYNTHESIS OF FUSED PYRROLECARBOXAMIDES PFIZER PRODUCTS INC. (US) 2002-06-13 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 (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-20040220253-A1 Synthesis of pyrrole amides GABRA5, GABRA2, GABRA1 LMNA 4764/4885CYP1A2 491/4885CYP3A4 510/4885
US-20020151718-A1 Synthesis of pyrrole amides GABRA5, GABRA2, GABRA1 LMNA 4764/4885CYP1A2 491/4885CYP3A4 510/4885

“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.