SCHEMBL7361266

SCHEMBL7361266

O=C(O)CCCCC1C(=O)OCN1C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.60
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
F2 P00734 2/20 0.41
ELANE P08246 2/20 0.41
CTSG P08311 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
PABPC1 P11940 1/20 0.41
CYP2C19 P33261 1/20 0.41
EIF4H Q15056 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL5711333 1.00 USP2 (0.60) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5324841 0.99 USP2 (0.59) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5324844 0.99 USP2 (0.59) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711279 0.97 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711402 0.97 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711299 0.92 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL3184957 0.92 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711284 0.92 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711215 0.91 USP2 (0.58) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5218287 0.88 USP2 (0.62) USP2PSEN1PSEN2APH1BNCSTN

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