SCHEMBL1976464

SCHEMBL1976464

Cc1c(CN)ccc(-c2ccc(CN)c(C)c2C)c1C

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
DPP4 P27487 2/20 0.34
PNMT P11086 2/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL4729834 0.89 PNMT (0.38) DPP4PNMTTAAR1
SCHEMBL394776 0.79 TAAR1 (0.37) POLBDPP4PNMTTAAR1
Iodide SCHEMBL10967243 0.77 TAAR1 (0.35) POLBPNMTTAAR1
Water SCHEMBL4649643 0.77 TAAR1 (0.35) POLBPNMTTAAR1
Hydrochloric Acid SCHEMBL28656395 0.77 TAAR1 (0.35) POLBPNMTTAAR1
SCHEMBL3572188 0.77 CYP3A4 (0.42) PNMT
SCHEMBL11154126 0.75 TYR (0.41) TAAR1
SCHEMBL16553485 0.75 PNMT (0.44) DPP4PNMTTAAR1
SCHEMBL2007620 0.75 PNMT (0.30) PNMT
SCHEMBL6706730 0.75 TAAR1 (0.32) PNMTTAAR1

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-8765893-B2 Norbornene-type polymers having quaternary ammonium functionality PROMERUS, LLC (US) 2014-07-01 US disclosed
US-8765894-B2 Norbornene-type polymers having quaternary ammonium functionality PROMERUS, LLC (US) 2014-07-01 US disclosed
US-20110244368-A1 NORBORNENE-TYPE POLYMERS HAVING QUATERNARY AMMONIUM FUNCTIONALITY PROMERUS LLC (US) 2011-10-06 US disclosed
US-20110143260-A1 NORBORNENE-TYPE POLYMERS HAVING QUATERNARY AMMONIUM FUNCTIONALITY PROMERUS LLC (US) 2011-06-16 US disclosed