SCHEMBL9303608

SCHEMBL9303608

C=CCCCCc1ccc(C(=O)Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.47
KMT2A Q03164 8/20 0.46
MEN1 O00255 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 5/20 0.45
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PPARA Q07869 2/20 0.42
HTT P42858 1/20 0.42
PPARG P37231 1/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40

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
SCHEMBL9303397 0.96 KMT2A (0.47) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL8913713 0.91 KMT2A (0.49) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL9303442 0.91 KMT2A (0.49) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL8911968 0.87 THRB (0.60) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL9304788 0.87 MAPT (0.52) THRBKMT2ASMN1; SMN2MAPTCYP2C9
SCHEMBL8913231 0.87 THRB (0.57) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL9302777 0.85 GPR52 (0.45) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL10798412 0.84 THRB (0.64) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL10799184 0.84 THRB (0.64) THRBKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL8915970 0.84 F2 (0.48) THRBSMN1; SMN2MAPTALDH1A1L3MBTL1

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
US-5304667-A Cyclosiloxanes containing mesogenic side groups CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-04-19 US disclosed
US-5221759-A CYCLOSILOXANES CONTAINING MESOGENIC SIDE GROUPS CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1993-06-22 US disclosed