SCHEMBL8958534

SCHEMBL8958534

O=C1CCCCN1C(=O)Cc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
ME2 P23368 4/20 0.43
ME1 P48163 4/20 0.43
ME3 Q16798 4/20 0.43
CA2 P00918 2/20 0.43
CAMK2A Q9UQM7 1/20 0.43
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MITF O75030 1/20 0.41
FAAH O00519 1/20 0.41
NAAA Q02083 1/20 0.41
MAPT P10636 1/20 0.41
CASP3 P42574 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL10622638 0.86 HPGD (0.52) LMNASMN1; SMN2NPC1HPGDME2
SCHEMBL10617935 0.86 LMNA (0.50) LMNASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL7172773 0.84 LMNA (0.57) LMNASMN1; SMN2NPC1ME2ME1
SCHEMBL6439273 0.82 LMNA (0.58) LMNASMN1; SMN2HPGDALDH1A1FAAH
SCHEMBL9718009 0.80 LMNA (0.47) LMNASMN1; SMN2NPC1KMT2AALDH1A1
SCHEMBL10511883 0.78 LMNA (0.45) LMNASMN1; SMN2KMT2AALDH1A1MITF
SCHEMBL15985154 0.78 SMN1; SMN2 (0.69) SMN1; SMN2NPC1HPGDME2ME1
SCHEMBL2236040 0.76 SMN1; SMN2 (0.72) SMN1; SMN2NPC1HPGDME2ME1
SCHEMBL16425193 0.75 ALDH1A1 (0.45) LMNASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL6535800 0.75 ALDH1A1 (0.64) SMN1; SMN2KMT2AALDH1A1FAAHNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8193017-A None JP disclosed
JP-H08193017-A SEED TAKI CHEM CO LTD 1996-07-30 JP disclosed
EP-0294053-B1 Composition for agricultural use TAKI CHEMICAL (JP) 1994-08-10 EP disclosed