SCHEMBL7362144

SCHEMBL7362144

COC(=O)C(CCCCC(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 3/20 0.67
▸ SIRT1 Q96EB6 2/20 0.67
▸ SIRT3 Q9NTG7 1/20 0.67
▸ SIRT5 Q9NXA8 3/20 0.57
▸ KYNU Q16719 1/20 0.57
▸ FOLH1 Q04609 2/20 0.57
▸ HTT P42858 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ CTSL P07711 2/20 0.55
▸ CTSS P25774 1/20 0.55
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53

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
SCHEMBL31243031 0.96 SIRT2 (0.62) SIRT2SIRT1SIRT3SIRT5KYNU
SCHEMBL8386880 0.93 SIRT2 (0.67) SIRT2SIRT1SIRT3SIRT5KYNU
SCHEMBL6259518 0.91 KYNU (0.60) SIRT2SIRT1SIRT3KYNUFOLH1
SCHEMBL2777678 0.91 KYNU (0.60) SIRT2SIRT1SIRT3KYNUFOLH1
SCHEMBL221391 0.91 KYNU (0.60) SIRT2SIRT1SIRT3KYNUFOLH1
SCHEMBL27462111 0.90 SIRT2 (0.67) SIRT2SIRT1SIRT3KYNUALDH1A1
SCHEMBL5711292 0.90 FOLH1 (0.69) SIRT2SIRT1SIRT3SIRT5FOLH1
SCHEMBL9828826 0.90 FOLH1 (0.69) SIRT2SIRT1SIRT3SIRT5FOLH1
SCHEMBL5323583 0.88 FOLH1 (0.67) SIRT2SIRT1SIRT3SIRT5FOLH1
SCHEMBL1199556 0.88 SIRT2 (0.74) SIRT2SIRT1SIRT3KYNUALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415981-A4 RETROVIRAL PROTEASE INHIBITORS — 1991-10-09 — — EP disclosed
US-5032577-A Hypotensive ABBOTT LABORATORIES (US) 1991-07-16 — — US disclosed
EP-0415981-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1991-03-13 — — EP disclosed
EP-0295294-A4 PEPTIDYLAMINODIOLS. ABBOTT LAB (US) 1990-04-10 — — EP disclosed
EP-0342541-A2 Retroviral protease inhibitors ABBOTT LABORATORIES (US) 1989-11-23 — — EP disclosed
WO-1989010752-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1989-11-16 — — WO disclosed
EP-0295294-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-12-21 — — EP disclosed
WO-1988005050-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-07-14 — — WO disclosed
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