SCHEMBL9303970

SCHEMBL9303970

C=CCCCc1ccc(C(=O)Oc2ccc(OC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
GFER P55789 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
THRB P10828 2/20 0.48
GPR52 Q9Y2T5 1/20 0.47
PRSS1 P07477 1/20 0.47
ACR P10323 1/20 0.47
PKM P14618 1/20 0.46
ALOX5 P09917 1/20 0.46
CYP4A11 Q02928 2/20 0.46
GAA P10253 1/20 0.45
CALM1 P0DP23 1/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL9304788 0.96 MAPT (0.52) MAPTGFERKMT2ASMN1; SMN2NPC1
SCHEMBL9302751 0.92 KMT2A (0.56) MAPTGFERKMT2ASMN1; SMN2NPC1
SCHEMBL8913018 0.92 KMT2A (0.56) MAPTGFERKMT2ASMN1; SMN2NPC1
SCHEMBL8923657 0.89 THRB (0.58) MAPTKMT2ASMN1; SMN2NPC1LMNA
SCHEMBL8913584 0.89 THRB (0.58) MAPTKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL10798412 0.88 THRB (0.64) MAPTKMT2ASMN1; SMN2CYP1A2THRB
SCHEMBL10799184 0.88 THRB (0.64) MAPTKMT2ASMN1; SMN2CYP1A2THRB
SCHEMBL9256719 0.86 THRB (0.45) MAPTKMT2ASMN1; SMN2LMNATHRB
SCHEMBL9303397 0.86 KMT2A (0.47) MAPTKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL8913231 0.85 THRB (0.57) MAPTKMT2ASMN1; SMN2NPC1RAB9A

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