SCHEMBL15331069

SCHEMBL15331069

O=Cc1cc(-c2cc(C(=O)O)cc(C(F)(F)F)c2)cs1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.49
RXRB P28702 4/20 0.49
RXRG P48443 3/20 0.49
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
DHODH Q02127 1/20 0.39
CES2 O00748 1/20 0.39
CFTR P13569 1/20 0.38
P2RY14 Q15391 6/20 0.36
SRD5A2 P31213 2/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
SLC6A2 P23975 1/20 0.35

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
SCHEMBL18002272 0.85 RXRA (0.40) RXRARXRBRXRGCES2CNR1
SCHEMBL15331511 0.81 HCAR1 (0.43) CES2
SCHEMBL17048588 0.79 RXRA (0.72) RXRARXRBRXRGDHODHCES2
SCHEMBL15332306 0.79 CA12 (0.47) KDM4EMEN1ALDH1A1KMT2ADHODH
SCHEMBL2563115 0.78 RXRA (0.47) RXRARXRBRXRGKDM4EMEN1
SCHEMBL2557141 0.78 TPMT (0.48) RXRARXRBKDM4EMEN1KMT2A
SCHEMBL2554759 0.78 KDM4E (0.35) KDM4EMEN1ALDH1A1KMT2ADHODH
SCHEMBL2554127 0.77 RXRA (0.64) RXRARXRBRXRGALDH1A1DHODH
SCHEMBL3082270 0.76 RXRA (0.72) RXRARXRBRXRGDHODHCES2
SCHEMBL2562291 0.74 RXRA (0.49) RXRAKDM4EALDH1A1

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