SCHEMBL8771872

SCHEMBL8771872

CC1(C)C=C(c2ccccc2)c2cc(OCc3ccc(C(=O)O)cc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.51
NR4A1 P22736 1/20 0.51
NR4A3 Q92570 1/20 0.51
RXRA P19793 8/20 0.48
RXRB P28702 8/20 0.48
RXRG P48443 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
SRD5A2 P31213 2/20 0.48
POLB P06746 1/20 0.48
P2RY14 Q15391 1/20 0.47
TSHR P16473 1/20 0.47
PLA2G4B P0C869 1/20 0.46
NR1H4 Q96RI1 1/20 0.44

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
SCHEMBL8771810 0.90 KMT2A (0.48) NPC1RAB9ASMN1; SMN2
SCHEMBL17275573 0.80 RARB (0.50) RXRASRD5A2POLB
SCHEMBL4653407 0.76 RARB (0.69) RXRASRD5A2
SCHEMBL4653408 0.76 RARB (0.69) RXRASRD5A2
SCHEMBL4653505 0.74 RXRA (0.53) RXRARXRBSRD5A2
SCHEMBL4653413 0.74 RARA (0.71) RXRAP2RY14TSHR
SCHEMBL8674842 0.73 RXRA (0.68) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL1756343 0.73 NR4A2 (0.81) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL5582767 0.73 NR4A2 (0.81) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL8437505 0.72 NR4A2 (0.62) NR4A2NR4A1NR4A3RXRARXRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661259-B1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL MYERS SQUIBB CO (US) 1997-10-08 EP claimed
US-5618839-A Retinoid-like compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1997-04-08 US disclosed