SCHEMBL8890902

SCHEMBL8890902

CSc1ccc(C(=O)c2cnoc2C2CC2)c(CCc2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
ABL1 P00519 1/20 0.37
SRC P12931 1/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 2/20 0.35
DRD2 P14416 1/20 0.35
HTR1A P08908 2/20 0.34
CASP3 P42574 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
SCN1A P35498 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
SCHEMBL8891282 0.92 HPGD (0.36) RAB9ASMN1; SMN2NPC1MAPTABL1
SCHEMBL8494970 0.86 HPGD (0.35) RAB9ASMN1; SMN2MEN1KMT2AHPGD
SCHEMBL8893348 0.85 ALDH1A1 (0.43) SMN1; SMN2MAPTMEN1KMT2AHPGD
SCHEMBL8890372 0.84 FFAR4 (0.36) RAB9AMAPTGAASCN1ASCN2A
SCHEMBL7576529 0.84 HPGD (0.34) RAB9ASMN1; SMN2MEN1KMT2AHPGD
SCHEMBL8889689 0.83 HPGD (0.39) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL8891642 0.83 ALDH1A1 (0.39) MEN1KMT2AALDH1A1GAADRD2
SCHEMBL8890322 0.83 NAMPT (0.33) MEN1KMT2AALDH1A1SCN1ASCN2A
SCHEMBL8892485 0.82 MAPT (0.35) RAB9ANPC1MAPTKMT2AHPGD
SCHEMBL8890896 0.82 TBXA2R (0.41) MAPTMEN1KMT2AHPGDALDH1A1

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed