SCHEMBL1077208

SCHEMBL1077208

CC(C)CCN([C@H](CO)CCCCNC(=O)N(Cc1ccc(C(F)(F)F)cc1)Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 11/20 0.42
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 2/20 0.38
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MMP2 P08253 1/20 0.37
MMP13 P45452 1/20 0.37

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
SCHEMBL6624074 1.00 BMP1 (0.42) BMP1ALDH1A1SMN1; SMN2NPSR1TP53
SCHEMBL1039183 0.93 BMP1 (0.43) BMP1NPSR1TP53HSD17B10MEN1
SCHEMBL1077690 0.93 BMP1 (0.43) BMP1ALDH1A1SMN1; SMN2NPSR1TP53
SCHEMBL6679488 0.93 BMP1 (0.43) BMP1ALDH1A1SMN1; SMN2NPSR1TP53
SCHEMBL6685014 0.92 BMP1 (0.46) BMP1ALDH1A1SMN1; SMN2NPSR1MEN1
SCHEMBL1078022 0.92 BMP1 (0.46) BMP1ALDH1A1SMN1; SMN2NPSR1MEN1
SCHEMBL6622848 0.91 BMP1 (0.45) BMP1NPSR1TP53HSD17B10MEN1
SCHEMBL1039459 0.91 BMP1 (0.45) BMP1NPSR1TP53HSD17B10MEN1
SCHEMBL1076810 0.90 BMP1 (0.53) BMP1
SCHEMBL1077694 0.89 BMP1 (0.47) BMP1ALDH1A1SMN1; SMN2NPSR1TP53

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-B1 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS AMBRILIA BIOPHARMA INC (CA) 2011-01-26 EP disclosed
US-6528532-B1 Benzenesulfonamide group PHARMACOR INC. (CA) 2003-03-04 US disclosed