SCHEMBL1975685

SCHEMBL1975685

Cc1c(C)c2c(c(C)c1N)-c1cc(N)ccc1C2C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 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
SCHEMBL8970938 0.68 PDE10A (0.38) PDE10AALDH1A1CDK5CDK5R1
SCHEMBL942118 0.60 ALDH1A1 (0.39) PDE10AALDH1A1CDK5CDK5R1
SCHEMBL16937411 0.60 CYP3A4 (0.50) ALDH1A1
SCHEMBL28450674 0.60 MAP4K4 (0.49) ALDH1A1
SCHEMBL28216630 0.57 ALDH1A1 (0.37) PDE10AALDH1A1CDK5CDK5R1
SCHEMBL28729915 0.57 CHEK1 (0.43) ALDH1A1CDK5
Benzidine SCHEMBL9766924 0.57 CYP3A4 (0.65) ALDH1A1
SCHEMBL30092397 0.57 PLA2G7 (0.65) PDE10AALDH1A1
SCHEMBL31607621 0.57 PLA2G7 (0.65) PDE10AALDH1A1
SCHEMBL8848693 0.57 PLA2G7 (0.65) PDE10AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765894-B2 Norbornene-type polymers having quaternary ammonium functionality PROMERUS, LLC (US) 2014-07-01 US disclosed
US-8765893-B2 Norbornene-type polymers having quaternary ammonium functionality PROMERUS, LLC (US) 2014-07-01 US disclosed
EP-2510036-A2 NORBORNENE-TYPE POLYMERS HAVING QUATERNARY AMMONIUM FUNCTIONALITY Promerus LLC (US) 2012-10-17 EP 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
WO-2011072304-A2 NORBORNENE-TYPE POLYMERS HAVING QUATERNARY AMMONIUM FUNCTIONALITY PROMERUS LLC (US) 2011-06-16 WO disclosed