SCHEMBL11960754

SCHEMBL11960754

CCCC(CCC)c1ccc(C(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 3/20 0.51
SNCA P37840 1/20 0.51
HDAC1 Q13547 2/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
BDKRB2 P30411 1/20 0.49
HDAC3 O15379 1/20 0.49
HDAC2 Q92769 1/20 0.49
NCOR2 Q9Y618 1/20 0.49
NQO2 P16083 2/20 0.49
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
POLB P06746 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
ESRRG P62508 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
PPARG P37231 1/20 0.46

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
SCHEMBL6555841 0.80 LMNA (0.68) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL8420639 0.79 DEGS1 (0.75) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL899585 0.79 DEGS1 (0.75) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL984302 0.79 ESR1 (0.74) ESR1ESR2KMT2AKDM4ELMNA
SCHEMBL900928 0.79 DEGS1 (0.75) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL4747814 0.77 TRPV1 (0.61) DEGS1SNCAESR1ESR2NQO2
SCHEMBL16610194 0.76 DEGS1 (0.61) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL28034393 0.76 DEGS1 (0.58) DEGS1SNCANQO2NPC1RAB9A
SCHEMBL11138237 0.75 ESR1 (0.63) DEGS1SNCAESR1ESR2BDKRB2
SCHEMBL11676225 0.74 MEN1 (0.77) DEGS1SNCANQO2NPC1RAB9A

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-1799663-B1 Modulators of HCV replication ANGELETTI P IST RICHERCHE BIO (IT) 2012-08-01 EP disclosed