SCHEMBL3421138

SCHEMBL3421138

C=CCC1(I)CC2CCC(C1)N2C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL13246764 0.77 LMNA (0.30) LMNACYP2C9
SCHEMBL26044406 0.68 LMNA (0.39) LMNACYP2C9
SCHEMBL25462618 0.67 LMNA (0.34) LMNACYP2C9
SCHEMBL19250232 0.63 SLC6A4 (0.32)
SCHEMBL8079753 0.62 LMNA (0.42) LMNACYP2C9
SCHEMBL14298073 0.62 LMNA (0.42) LMNACYP2C9
SCHEMBL4667124 0.61 CYP2C9 (0.48) LMNACYP2C9
SCHEMBL19254913 0.61 LMNA (0.37) LMNACYP2C9
SCHEMBL25460577 0.61 ALDH1A1 (0.35) LMNACYP2C9
SCHEMBL21216586 0.60 LMNA (0.40) LMNACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859641-B1 DOPAMINE TRANSPORTER IMAGING AGENT HARVARD COLLEGE (US) 2012-10-17 EP disclosed
EP-1051980-B1 Dopamine transporter imaging agents HARVARD COLLEGE (US) 2010-12-15 EP disclosed
US-20070009432-A1 Boat tropanes PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-01-11 US disclosed
US-7105678-B2 Boat tropanes ORGANIX, INC. (US) 2006-09-12 US disclosed
EP-1518562-A2 Dopamine transporter imaging agents PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-03-30 EP disclosed
EP-1518561-A2 Dopamine transporter imaging agents PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-03-30 EP disclosed
US-6548041-B1 Diagnosis, therapy of central nervous system disorders ORGANIX, INC. 2003-04-15 US disclosed
US-20020131931-A1 Boat tropanes WILMINGTON TRUST (LONDON) LIMITED, AS SECURITY AGENT (GB) 2002-09-19 US disclosed
EP-1238978-A2 Intermediates for the synthesis of radiolabelled tropanes PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2002-09-11 EP disclosed
US-6171576-B1 TROPANE COMPOUND IS LINKED THROUGH THE N ATOM AT THE 8-POSITION TO A CHELATING LIGAND CAPABLE OF COMPLEXING TECHNETIUM OR RHENIUM TO PRODUCE A NEUTRAL LABELED COMPLEX THAT SELECTIVELY BINDS TO THE DOPAMINE TRANSPORTER. ORGANIX INC. 2001-01-09 US disclosed
EP-1051980-A2 Dopamine transporter imaging agents PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2000-11-15 EP disclosed
EP-0859641-A4 DOPAMINE TRANSPORTER IMAGING AGENT HARVARD COLLEGE (US) 1999-05-26 EP disclosed
EP-0859641-A1 DOPAMINE TRANSPORTER IMAGING AGENT PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1998-08-26 EP disclosed
WO-1997016210-A1 DOPAMINE TRANSPORTER IMAGING AGENT PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1997-05-09 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-20020131931-A1 Boat tropanes SLC6A3, SLC18A2, SLC6A4 LMNA 3834/4885CYP2C9 1874/4885
US-20070009432-A1 Boat tropanes SLC6A3, SLC18A2, SLC6A4 LMNA 3834/4885CYP2C9 1874/4885

“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.