SCHEMBL19339482

SCHEMBL19339482

CCC(C)(CC)c1ccc(Oc2ccc(C(=O)c3ccc(Oc4ccc(C(C)(CC)CC)cc4)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.49
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
POLB P06746 1/20 0.48
CYP2C9 P11712 1/20 0.48
SRD5A2 P31213 5/20 0.47
HPGD P15428 2/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL19416348 0.94 ELANE (0.54) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL22304593 0.91 RAB9A (0.42) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL20144384 0.91 RAB9A (0.42) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL12943146 0.91 RAB9A (0.42) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL13918667 0.90 ELANE (0.50) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL13703526 0.88 LMNA (0.55) ELANERAB9ANPC1HPGDMAPT
SCHEMBL13374819 0.87 RAB9A (0.40) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL20144414 0.87 ACACB (0.41) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL20144400 0.87 ACACB (0.41) ELANERAB9ANPC1POLBCYP2C9
SCHEMBL20144377 0.87 ACACB (0.41) ELANERAB9ANPC1POLBCYP2C9

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
EP-3216820-B1 POLYARYLETHER KETONE IMIDE SULFONE ADHESIVES BOEING CO (US) 2020-09-23 EP disclosed
EP-3216820-A1 POLYARYLETHER KETONE IMIDE SULFONE ADHESIVES The Boeing Company (US) 2017-09-13 EP disclosed