SCHEMBL2563402

SCHEMBL2563402

COc1ccc(C=O)cc1CN1CCC(N)C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.50
ALDH1A1 P00352 10/20 0.48
MAPT P10636 4/20 0.44
TSHR P16473 1/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 2/20 0.43
TACR1 P25103 1/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 1/20 0.42
CYP1A2 P05177 1/20 0.42
FDPS P14324 1/20 0.42
CCR5 P51681 1/20 0.41

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
SCHEMBL2562461 0.93 MAPT (0.50) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL15330421 0.93 RXFP1 (0.52) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL2562169 0.86 RXFP1 (0.48) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL2556584 0.82 NPC1 (0.50) RXFP1ALDH1A1MAPTLMNAMEN1
SCHEMBL27339614 0.81 CCR5 (0.49) MAPTTSHRMEN1KMT2ASMN1; SMN2
SCHEMBL25640341 0.80 KDM4E (0.61) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL17864792 0.79 KDM4E (0.63) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL24234742 0.79 RXFP1 (0.54) RXFP1ALDH1A1MAPTLMNAMEN1
SCHEMBL24234716 0.79 KDM4E (0.50) RXFP1ALDH1A1MAPTTSHRLMNA
SCHEMBL348999 0.78 MAPT (0.64) RXFP1ALDH1A1MAPTLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed