SCHEMBL15330429

SCHEMBL15330429

COc1ccccc1Nc1ncc(C=O)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
LRRK2 Q5S007 1/20 0.52
MAPT P10636 6/20 0.51
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 2/20 0.51
KDM4E B2RXH2 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
EGFR P00533 1/20 0.51
NPC1 O15118 2/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
PTK2 Q05397 1/20 0.46
PKM P14618 1/20 0.46
MAPK10 P53779 1/20 0.46
CNR2 P34972 1/20 0.45
MAPK1 P28482 1/20 0.45
ALK Q9UM73 2/20 0.45

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
SCHEMBL2561417 0.87 MAPK10 (0.49) MAPTALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL30780322 0.80 LRRK2 (0.56) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL22191522 0.80 LRRK2 (0.56) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL30260564 0.80 LRRK2 (0.56) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL20004385 0.79 EGFR (0.71) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL28220480 0.77 MAPT (0.71) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL13043773 0.76 MAPT (0.63) RAB9AMAPTALDH1A1KMT2AKDM4E
SCHEMBL2559656 0.76 HDAC3 (0.57) RAB9AMAPTALDH1A1KMT2AKDM4E
SCHEMBL11813903 0.75 MAPT (0.83) RAB9ALRRK2MAPTALDH1A1KMT2A
SCHEMBL29951333 0.74 ULK1 (0.51) RAB9AMAPTALDH1A1KDM4ESMN1; SMN2

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 5 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