SCHEMBL15329658

SCHEMBL15329658

C=CCOc1ccc(C(F)(F)F)cc1B(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HTT P42858 2/20 0.40
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 3/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 4/20 0.37
HPGD P15428 1/20 0.37
CYP2D6 P10635 2/20 0.36
LIPE Q05469 1/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MGLL Q99685 2/20 0.36

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
SCHEMBL986881 0.81 CYP1A2 (0.55) KMT2AMEN1KDM4ECYP1A2CYP2C9
SCHEMBL29950647 0.81 CYP1A2 (0.55) KMT2AMEN1KDM4ECYP1A2CYP2C9
SCHEMBL29957552 0.80 MAPT (0.47) KMT2AMEN1HTTKDM4ECYP1A2
SCHEMBL29953675 0.79 KDM4E (0.42) KMT2AHTTKDM4ECYP1A2CYP2C9
SCHEMBL29951691 0.78 KDM4E (0.41) KMT2AMEN1HTTKDM4ELMNA
SCHEMBL14029250 0.78 PTGDR2 (0.52) KMT2AHTTKDM4ECYP1A2CYP2C9
SCHEMBL14172733 0.78 ALDH1A1 (0.40) KMT2AMEN1HTTKDM4ECYP1A2
SCHEMBL16619915 0.77 GAA (0.37) KMT2AMEN1HTTKDM4ECYP1A2
SCHEMBL12076427 0.77 PTGDR2 (0.60) CYP2C19PPARDPTGDR2
SCHEMBL319585 0.76 ENPP2 (0.47) KMT2AMEN1KDM4ECYP1A2CYP2C9

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