SCHEMBL7396557

SCHEMBL7396557

O=C(CCn1cnc2c(=O)[nH]cnc21)N1CCC2(CC1)OCCO2

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 10/20 0.48
▸ PNP P00491 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ LMNA P02545 1/20 0.42

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
SCHEMBL7396558 0.80 HPRT1 (0.46) HPRT1PNPALDH1A1KDM4ELMNA
SCHEMBL7398061 0.77 OPRK1 (0.47) LMNA
SCHEMBL7374581 0.74 HPRT1 (0.64) HPRT1PNP
SCHEMBL7389719 0.73 HPRT1 (0.47) HPRT1PNP
SCHEMBL3060815 0.73 HPRT1 (0.63) HPRT1PNP
SCHEMBL7684892 0.70 HPRT1 (0.67) HPRT1PNP
SCHEMBL7397072 0.70 HPRT1 (0.59) HPRT1PNP
SCHEMBL7396839 0.70 HPRT1 (0.48) HPRT1PNPPOLB
SCHEMBL11258920 0.70 HPRT1 (0.69) HPRT1PNP
SCHEMBL7397889 0.69 MAPK1 (0.49) HPRT1PNPALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0522082-B1 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE GLASKY ALVIN J (US) 1997-07-02 — — EP disclosed
EP-0522082-A4 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE — 1993-06-09 — — EP disclosed
EP-0522082-A1 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE. GLASKY ALVIN J (US) 1993-01-13 — — EP disclosed
US-5091432-A Synergistic SPECTRUM PHARMACEUTICALS, INC. 1992-02-25 — — US disclosed
WO-1991014434-A1 MULTI-FUNCTIONAL PHARMACEUTICAL COMPOUNDS AND METHODS OF USE GLASKY ALVIN J (US) 1991-10-03 — — WO disclosed
Send feedback