SCHEMBL8667475

SCHEMBL8667475

O=C(NCC1(C(=O)O)CCCCC1)c1cccc(O)c1O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
TERT O14746 2/20 0.47
LMNA P02545 3/20 0.44
P2RX7 Q99572 3/20 0.42
EGLN2 Q96KS0 4/20 0.42
EGLN1 Q9GZT9 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HCN1 O60741 1/20 0.40
HCN4 Q9Y3Q4 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
SCHEMBL17026753 0.81 LMNA (0.47) LMNAP2RX7MEN1KMT2AGAA
SCHEMBL1756726 0.78 LMNA (0.63) LMNAP2RX7MEN1KMT2AGAA
SCHEMBL13067094 0.72 LMNA (0.71) LMNAP2RX7MEN1KMT2AGAA
SCHEMBL13952095 0.71 ALOX5 (0.82) ALOX5TERTALDH1A1
SCHEMBL3677100 0.71 ALOX5 (0.64) ALOX5TERTEGLN2EGLN1ALDH1A1
SCHEMBL29387023 0.71 ALOX5 (0.64) ALOX5TERTEGLN2EGLN1ALDH1A1
SCHEMBL11188791 0.70 TSHR (0.50) MEN1KMT2A
SCHEMBL15822231 0.70 P2RX7 (0.82) P2RX7
SCHEMBL26936095 0.70 ALOX5 (0.79) ALOX5TERTMEN1KMT2AALDH1A1
2,3-Dihydroxybenzoic Acid SCHEMBL10570084 0.69 SELL (0.61) ALOX5TERTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5854250-A N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process of preparing same GYOGYSZERKUTATO INTEZET KFT (HU) 1998-12-29 US disclosed
US-5705529-A ANTIISCHEMIC AGENTS, ANTIINFLAMMATORY AGENTS, AGING RESISTANCE, ATHERIOSCLEROSIS, NERVOUS SYSTEM DISORDERS GYOGYSZERKUTATO INTEZET KFT (HK) 1998-01-06 US disclosed
EP-0576941-B1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO (JP) 1997-09-03 EP disclosed
EP-0576941-A1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-01-05 EP disclosed