SCHEMBL15330576

SCHEMBL15330576

O=Cc1noc(-c2ccco2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.51
RAB9A P51151 9/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
TSHR P16473 4/20 0.51
CASP3 P42574 3/20 0.50
TP53 P04637 4/20 0.49
HSD17B10 Q99714 4/20 0.49
POLB P06746 4/20 0.49
PKM P14618 3/20 0.49
ALDH1A1 P00352 6/20 0.48
MAPT P10636 5/20 0.45
MAPK1 P28482 2/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
RECQL P46063 3/20 0.43
KDM4E B2RXH2 4/20 0.42
HPGD P15428 4/20 0.42

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
SCHEMBL1609658 0.74 SMN1; SMN2 (0.41) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL5660084 0.73 RAB9A (0.56) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL14562709 0.73 NR1H4 (0.57) NPC1RAB9ASMN1; SMN2CASP3TP53
SCHEMBL5660080 0.73 RAB9A (0.56) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL4743094 0.71 CASP3 (0.56) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL13930846 0.70 NPC1 (0.76) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL28882633 0.70 CASP3 (0.65) NPC1RAB9ASMN1; SMN2CASP3TP53
SCHEMBL12385450 0.69 RAB9A (0.51) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL15013375 0.69 CASP3 (0.54) NPC1RAB9ASMN1; SMN2TSHRCASP3
SCHEMBL91494 0.69 RAB9A (0.51) NPC1RAB9ASMN1; SMN2TSHRCASP3

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