Sugi Predict

Sugi Predict / Compounds / SCHEMBL6622848

SCHEMBL6622848

SCHEMBL6622848

CC(C)CCN(C(CO)CCCCNC(=O)N(Cc1ccc2c(c1)OCO2)CC(C)C)S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BMP1 P13497 13/20 0.45
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MMP2 P08253 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GAA P10253 1/20 0.38

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
SCHEMBL1039459 1.00 BMP1 (0.45) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL1078022 0.94 BMP1 (0.46) BMP1MEN1KMT2ANPSR1GAA
SCHEMBL6685014 0.94 BMP1 (0.46) BMP1MEN1KMT2ANPSR1GAA
SCHEMBL1039183 0.93 BMP1 (0.43) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL1077690 0.93 BMP1 (0.43) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL6679488 0.93 BMP1 (0.43) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL1076810 0.92 BMP1 (0.53) BMP1
SCHEMBL1077208 0.91 BMP1 (0.42) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL6624074 0.91 BMP1 (0.42) BMP1MEN1KMT2AMMP2MMP13
SCHEMBL1077694 0.91 BMP1 (0.47) BMP1MEN1KMT2AMMP2MMP13

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-1480941-A2 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS Procyon Biopharma Inc. (CA) 2004-12-01 — — EP disclosed
WO-2003074467-A2 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS PROCYON BIOPHARMA INC. (CA) 2003-09-12 — — WO disclosed