SCHEMBL11063409

SCHEMBL11063409

CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3ccccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORA P35398 1/20 0.38
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
PLA2G2A P14555 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
CNR2 P34972 3/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL11067919 0.94 RORA (0.43) RORARORCRORBPLA2G2AMEN1
SCHEMBL11058958 0.90 RORA (0.36) RORARORCRORBTDP1L3MBTL1
SCHEMBL11235510 0.88 RORA (0.36) RORARORCRORBPLA2G2ATDP1
SCHEMBL11245349 0.87 GSK3A (0.36) RORARORCRORBPLA2G2AMEN1
SCHEMBL3877954 0.87 ALDH1A1 (0.38) L3MBTL1CYP2C9CYP2C19MEN1RECQL
SCHEMBL11063319 0.86 ALDH1A1 (0.36) TDP1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL11374312 0.86 MAPT (0.32) RORARORCRORBTDP1L3MBTL1
SCHEMBL11071245 0.84 ALDH1A1 (0.35) TDP1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL11250433 0.83 RORA (0.36) RORARORCRORBPLA2G2AMEN1
SCHEMBL11065740 0.83 ALDH1A1 (0.41) RORARORCRORBTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4431819-A PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS COPYING; HECTOGRAPHY; XERORAPHY STERLING DRUG INC. (US) 1984-02-14 US claimed
US-4431819-A PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS COPYING; HECTOGRAPHY; XERORAPHY STERLING DRUG INC. (US) 1984-02-14 US disclosed
EP-0024727-B1 ANTHRACYCLINE GLYCOSIDES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FARMITALIA CARLO ERBA S.p.A. (IT) 1982-05-26 EP disclosed
US-4251092-A COATED WITH A 3-HETERO-3-(DIPHENYLAMINO)PHTHALIDES COLOR FORMER STERLING DRUG INC. (US) 1981-02-17 US disclosed
US-4182714-A CARBONLESS COLORING DUPLICATING STERLING DRUG INC. (US) 1980-01-08 US disclosed