SCHEMBL9011602

SCHEMBL9011602

Cc1ccc(OCCCCCCOc2ccc(C)cc2C)c(C)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.57
L3MBTL1 Q9Y468 5/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
KMT2A Q03164 1/20 0.56
RELA Q04206 1/20 0.56
MAPT P10636 1/20 0.54
HPGD P15428 3/20 0.53
TSHR P16473 2/20 0.53
MAPK1 P28482 1/20 0.53
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 4/20 0.53
ATM Q13315 1/20 0.51
HTT P42858 1/20 0.51
S1PR4 O95977 1/20 0.50
L3MBTL4 Q8NA19 1/20 0.50
L3MBTL3 Q96JM7 1/20 0.50
GLA P06280 1/20 0.50

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
SCHEMBL9011659 1.00 SMN1; SMN2 (0.57) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL9011867 0.98 SMN1; SMN2 (0.59) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL17484853 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL14382370 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL11956138 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL2713160 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL14015788 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL13308494 0.92 ESR1 (0.56) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL9011759 0.92 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1
SCHEMBL891407 0.91 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1NPC1RAB9ANFKB1

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-5529874-A ETHER CARRIER LIQUID AND TONER PARTICLES DISPERSED THEREIN; SUITABLE FOR HIGH SPEED COPYING FUJI XEROX CO., LTD. (JP) 1996-06-25 US disclosed