SCHEMBL2557747

SCHEMBL2557747

OB(O)c1cnc(-c2cccc(Cl)c2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.44
CYP19A1 P11511 1/20 0.41
DYRK3 O43781 1/20 0.41
CCNT1 O60563 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK9 P50750 1/20 0.41
CDK5 Q00535 1/20 0.41
DYRK1A Q13627 1/20 0.41
CDK5R1 Q15078 1/20 0.41
DYRK2 Q92630 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
ALOX5 P09917 1/20 0.41
DHFR P00374 1/20 0.41
SCN2A Q99250 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MGLL Q99685 1/20 0.39

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
SCHEMBL2563179 0.81 HPGDS (0.51) IDO1NPC1RAB9ASMN1; SMN2MGLL
SCHEMBL2559693 0.79 RAB9A (0.46) IDO1NPC1RAB9ASMN1; SMN2MGLL
SCHEMBL15331161 0.78 ENPP2 (0.52) NPC1RAB9ASMN1; SMN2MAP4K4
SCHEMBL21125562 0.77 NPC1 (0.58) NPC1RAB9ASMN1; SMN2MGLL
SCHEMBL2131570 0.77 DHFR (0.51) IDO1CYP19A1ALOX5DHFRSCN2A
SCHEMBL2616114 0.77 IDO1 (0.47) IDO1CYP19A1DHFRSCN2ANPC1
SCHEMBL2223578 0.76 FYN (0.48) IDO1CYP19A1DYRK3CCNT1CCNA2
SCHEMBL13275140 0.76 NPC1 (0.55) NPC1RAB9APOLBSMN1; SMN2MAP4K4
SCHEMBL29381555 0.76 MGLL (0.67) ALOX5MGLL
SCHEMBL16908287 0.76 MGLL (0.67) ALOX5MGLL

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