SCHEMBL16343752

SCHEMBL16343752

Cc1cc(C)c(Oc2ccc(C(=O)Nc3ccccc3)cc2)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.57
NR1H4 Q96RI1 2/20 0.57
KCNK9 Q9NPC2 1/20 0.55
RAB9A P51151 8/20 0.54
NPC1 O15118 7/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
TP53 P04637 2/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
AR P10275 1/20 0.53
MAPT P10636 1/20 0.53
PTPN1 P18031 1/20 0.51
RECQL P46063 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 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
SCHEMBL16378118 0.84 MAPT (0.40) PGRNR1H4KCNK9RAB9ANPC1
SCHEMBL16343624 0.81 ELANE (0.53)
SCHEMBL19619022 0.80 PGR (0.86) PGRNR1H4RAB9ANPC1KMT2A
SCHEMBL14363134 0.80 PGR (0.79) PGRNR1H4RAB9ANPC1KMT2A
SCHEMBL14632524 0.79 NPC1 (0.74) PGRNR1H4KCNK9RAB9ANPC1
SCHEMBL16378117 0.79 PGR (0.44) PGRNR1H4RAB9ANPC1KMT2A
SCHEMBL2846809 0.79 LPAR1 (0.51) KMT2ASMN1; SMN2
SCHEMBL22192258 0.77 PGR (0.93) PGRNR1H4RAB9ANPC1KMT2A
SCHEMBL178425 0.77 RAB9A (0.85) KCNK9RAB9ANPC1KMT2AMEN1
SCHEMBL13211973 0.76 NR1H4 (0.68) PGRNR1H4KCNK9RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216949-B2 Ketoxime- and amide-functionalized nanomaterials THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2015-12-22 US disclosed
US-20150011794-A1 KETOXIME- AND AMIDE-FUNCTIONALIZED NANOMATERIALS GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2015-01-08 US disclosed