SCHEMBL8781950

SCHEMBL8781950

O=C1CC(C(=O)Oc2ccccc2)CN1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.46
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
SLC5A1 P13866 9/20 0.43
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.40
CNR2 P34972 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6337554 0.81 KMT2A (0.41) HTTKMT2ASMN1; SMN2TDP1POLB
SCHEMBL27796798 0.78 ELANE (0.53) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL28976958 0.77 HPGD (0.49) ELANETDP1TSHRALDH1A1HPGD
SCHEMBL12642500 0.75 ELANE (0.73) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL3193624 0.75 ELANE (0.73) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL12370828 0.75 ELANE (0.73) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL3175349 0.75 ELANE (0.58) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL3079124 0.75 ELANE (0.73) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL525974 0.75 ELANE (0.73) ELANEHTTKMT2ASMN1; SMN2TDP1
SCHEMBL27617914 0.75 ELANE (0.58) ELANEHTTKMT2ASMN1; SMN2TDP1

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-0804239-A1 ANTI-STRESS, ANTI-IMPAIRMENT AND ANTI-AGING DRUG AND PROCESS FOR MANUFACTURING THEREOF Riga, Dan (RO) 1997-11-05 EP disclosed
WO-1995033486-A1 ANTI-STRESS, ANTI-IMPAIRMENT AND ANTI-AGING DRUG AND PROCESS FOR MANUFACTURING THEREOF RIGA DAN (RO) 1995-12-14 WO disclosed