SCHEMBL806000

SCHEMBL806000

CCc1ccc2c(c1)c(Cl)nn2C1CCCCO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ RXRG P48443 1/20 0.41
▸ TRPC5 Q9UL62 2/20 0.37
▸ CYP4F2 P78329 3/20 0.35
▸ CYP4A11 Q02928 3/20 0.35
▸ DGAT2 Q96PD7 1/20 0.35
▸ TSHR P16473 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ RET P07949 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ ATR Q13535 1/20 0.33
▸ PGR P06401 1/20 0.32
▸ RORA P35398 1/20 0.32
▸ RORC P51449 1/20 0.32

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
SCHEMBL10231506 0.86 RXRA (0.41) RXRARXRBRXRGTRPC5CYP4F2
SCHEMBL21217456 0.83 RET (0.37) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30615352 0.81 MAPT (0.37) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL767343 0.81 RXRA (0.34) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21198132 0.79 CYP1A2 (0.44) CYP1A2ALDH1A1HPGDCNR2LMNA
SCHEMBL1114562 0.78 DGAT2 (0.38) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21217476 0.78 RXRA (0.37) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL10231494 0.76 RXRA (0.64) RXRARXRBRXRGTRPC5CYP4F2
SCHEMBL30615516 0.74 DGAT2 (0.38) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL14538890 0.74 GAA (0.41) RXRARXRBRXRGCYP4F2CYP4A11

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
WO-2012037410-A9 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ARAGON PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
WO-2012037410-A2 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ARAGON PHARMACEUTICALS, INC. (US) 2012-03-22 — — WO disclosed
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