SCHEMBL7318334

SCHEMBL7318334

COc1cc(N(C)CCN(C)Cc2ccccc2)cc(OC)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KDM4E B2RXH2 3/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.50
ALDH1A1 P00352 2/20 0.48
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
BLM P54132 1/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
PRMT8 Q9NR22 1/20 0.45
BCHE P06276 2/20 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
SCHEMBL7268018 0.88 KDM4E (0.65) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL9708987 0.86 POLB (0.51) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL15720901 0.82 KDM4E (0.73) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL7273776 0.78 L3MBTL1 (0.59) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL9709038 0.75 TSHR (0.59) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL9750783 0.74 ALDH1A1 (0.51) POLBSMN1; SMN2KDM4EGAAMAPT
SCHEMBL7055109 0.74 CARM1 (0.75) SMN1; SMN2KDM4ETSHRALDH1A1CYP3A4
SCHEMBL11639395 0.73 ALDH1A1 (0.61) SMN1; SMN2ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL4740336 0.71 KDM4E (0.68) SMN1; SMN2KDM4EGAAMAPTALDH1A1
SCHEMBL11113048 0.71 KDM4E (0.51) POLBSMN1; SMN2KDM4EGAAMAPT

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
EP-0293925-A2 Compound active in cardiovascular therapy SIMES, SOCIETA ITALIANA MEDICINALI E SINTETICI, S.P.A. (IT) 1988-12-07 EP disclosed