SCHEMBL2563543

SCHEMBL2563543

O=Cc1cc(Br)ccc1NCc1ccco1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
NOD2 Q9HC29 1/20 0.51
RAB9A P51151 4/20 0.49
NPC1 O15118 1/20 0.49
ALOX15 P16050 1/20 0.49
MAPT P10636 4/20 0.45
CRHBP P24387 2/20 0.45
CRHR2 Q13324 2/20 0.45
POLB P06746 3/20 0.43
WNK1 Q9H4A3 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MIF P14174 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
SCHEMBL874328 0.81 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2HTTHPGD
SCHEMBL2872971 0.75 ALDH1A1 (0.46) ALDH1A1LMNAHTTHPGDTSHR
SCHEMBL22836964 0.74 KDM4E (0.61) ALDH1A1LMNASMN1; SMN2HTTHPGD
SCHEMBL18993149 0.72 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2HTTHPGD
SCHEMBL230273 0.71 CA12 (0.67) ALDH1A1TSHRPOLBTDP1
SCHEMBL29855532 0.70 APP (0.69) ALDH1A1TSHRMAPTPOLBWNK1
SCHEMBL14514291 0.70 ALDH1A1 (0.48) ALDH1A1LMNAHPGDTSHRMAPK1
SCHEMBL22852468 0.70 APP (0.69) ALDH1A1TSHRMAPTPOLBWNK1
SCHEMBL22852421 0.68 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2HTTHPGD
SCHEMBL4343424 0.67 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2HTTHPGD

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