SCHEMBL2559946

SCHEMBL2559946

Cc1cc(C)cc(NC(=O)COc2cccc(C=O)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.59
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
HTT P42858 1/20 0.54
POLB P06746 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
TP53 P04637 2/20 0.52
MAOA P21397 2/20 0.51
MAOB P27338 2/20 0.51
LMNA P02545 1/20 0.51
NOTUM Q6P988 1/20 0.49

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
SCHEMBL2561781 0.91 MAPK1 (0.72) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2559333 0.90 HTT (0.60) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL15329477 0.86 MAPT (0.56) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL15330595 0.85 NPC1 (0.65) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2561612 0.85 NPC1 (0.61) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2554168 0.84 HPGD (0.64) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2553661 0.84 NPC1 (0.72) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL2559460 0.83 MEN1 (0.59) MAPK1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2556394 0.82 KMT2A (0.57) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL2558466 0.82 SMN1; SMN2 (0.62) MAPK1MEN1KMT2ASMN1; SMN2NPC1

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