SCHEMBL9621707

SCHEMBL9621707

Cc1cc(C)c(S(=O)(=O)N2CCCCC2)c(C)c1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EBP Q15125 4/20 0.71
DHCR7 Q9UBM7 4/20 0.71
NPC1 O15118 1/20 0.71
NPSR1 Q6W5P4 2/20 0.71
EPHX2 P34913 5/20 0.61
ALDH1A1 P00352 4/20 0.59
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
GAA P10253 1/20 0.56
POLB P06746 1/20 0.56
HTT P42858 1/20 0.56
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL17007504 0.84 EBP (1.00) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL17007435 0.84 EBP (1.00) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL22834209 0.83 NPSR1 (0.69) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL17007461 0.82 EBP (0.97) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL7076796 0.81 NPSR1 (0.67) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL29483654 0.81 NPSR1 (0.67) EBPDHCR7NPC1NPSR1ALDH1A1
SCHEMBL17007406 0.81 NPSR1 (0.67) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL14411560 0.80 PKM (0.59) EBPDHCR7NPC1NPSR1ALDH1A1
SCHEMBL18711514 0.78 ALDH1A1 (0.71) EBPDHCR7NPC1NPSR1EPHX2
SCHEMBL22033211 0.77 EPHX2 (0.68) EBPDHCR7NPC1NPSR1EPHX2

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
CN-105873913-B Therapeutics targeting truncated Adenomatous Polyposis Coli (APC) proteins 得克萨斯系统大学评议会 2019-12-03 CN disclosed
EP-0254158-B1 PYRIMIDIN DERIVATIVES AND PROCESS FOR THEIR PREPARATION RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1992-01-29 EP disclosed
US-4960888-A Preparation of 6-amino-1,2-dihydro-1-hydroxy-2-imino-4-piperidinopyrimidine compounds RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1990-10-02 US disclosed
EP-0254158-A2 Pyrimidin derivatives and process for their preparation RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1988-01-27 EP disclosed
EP-0252515-A1 Process for the preparation of 6-amino-1,2-dihydro-1-hydroxy-2-imino-4-piperidino-pyrimidine RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1988-01-13 EP disclosed