SCHEMBL8972804

SCHEMBL8972804

CC=COc1ccc(C(=O)Oc2ccc(-c3ccc(OC)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.54
MAPT P10636 4/20 0.54
GFER P55789 1/20 0.54
LMNA P02545 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PRSS1 P07477 1/20 0.50
ACR P10323 1/20 0.50
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
GBA1 P04062 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
POLB P06746 1/20 0.44
CES2 O00748 1/20 0.43

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
SCHEMBL8840350 0.88 MAPT (0.51) KMT2AMAPTSMN1; SMN2PRSS1ACR
SCHEMBL16604902 0.86 LMNA (0.68) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL13859676 0.86 LMNA (0.68) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL14817293 0.86 LMNA (0.68) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL9403479 0.83 PARP10 (0.54) KMT2AMAPTSMN1; SMN2PRSS1ACR
SCHEMBL10578942 0.82 KMT2A (0.48) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL10578949 0.82 KMT2A (0.48) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL16573857 0.81 CA1 (0.75) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL16751100 0.81 CA1 (0.75) KMT2AMAPTGFERLMNACYP1A2
SCHEMBL12895907 0.81 CA1 (0.75) KMT2AMAPTGFERLMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5502206-A Liquid-crystalline organosiloxanes containing chiral tartarimides Consortium fu/ r elektrochemische Industrie GmbH (DE) 1996-03-26 US disclosed