SCHEMBL5157780

SCHEMBL5157780

CCCCN(C(=O)OC)c1ncncn1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 4/20 0.33
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PDE10A Q9Y233 1/20 0.32
LMNA P02545 1/20 0.31
STAT3 P40763 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
S1PR1 P21453 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
PTPN11 Q06124 1/20 0.31
HTT P42858 1/20 0.31
ELANE P08246 1/20 0.31

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
SCHEMBL5159308 0.82 MLYCD (0.36) MLYCDPDE10AS1PR1PTPN11ELANE
SCHEMBL10767534 0.78 NPC1 (0.41) MLYCDLMNAS1PR1
SCHEMBL6001688 0.71 NPC1 (0.55) KMT2AL3MBTL1MEN1GLATSHR
SCHEMBL3182836 0.70 HTT (0.41) TSHRTDP1LMNASMN1; SMN2HTT
SCHEMBL15263572 0.70 L3MBTL1 (0.43) L3MBTL1TSHRTDP1LMNASMN1; SMN2
SCHEMBL4422288 0.70 LMNA (0.38) L3MBTL1TSHRTDP1LMNASTAT3
SCHEMBL27892181 0.69 P2RX7 (0.31)
SCHEMBL4721367 0.69 LATS1 (0.37) TDP1LMNASMN1; SMN2PTPN11HTT
SCHEMBL4723666 0.67 CRHR1 (0.42) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL4765553 0.67 SMN1; SMN2 (0.39) TSHRLMNASMN1; SMN2HTT

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-1740555-B1 RADIATION CURABLE 1,3,5-TRIAZINE CARBAMATES AND 1,3,5-TRIAZINE UREAS CONTAINING VINYL GROUPS, METHACRYLOYL GROUPS, OR ACRYLOYL GROUPS BASF SE (DE) 2012-06-13 EP disclosed
EP-1740555-A1 RADIATION CURABLE 1,3,5-TRIAZINE CARBAMATES AND 1,3,5-TRIAZINE UREAS CONTAINING VINYL GROUPS, METHACRYLOYL GROUPS, OR ACRYLOYL GROUPS BASF AKTIENGESELLSCHAFT (DE) 2007-01-10 EP disclosed
EP-1737834-A1 METHOD FOR PRODUCING 1,3,5-TRIAZINE CARBAMATES AND UREAS BASF AKTIENGESELLSCHAFT (DE) 2007-01-03 EP disclosed
WO-2005103016-A1 RADIATION CURABLE 1,3,5-TRIAZINE CARBAMATES AND 1,3,5-TRIAZINE UREAS CONTAINING VINYL GROUPS, METHACRYLOYL GROUPS, OR ACRYLOYL GROUPS BASF AKTIENGESELLSCHAFT (DE) 2005-11-03 WO disclosed
WO-2005100328-A1 METHOD FOR PRODUCING 1,3,5-TRIAZINE CARBAMATES AND UREAS BASF AKTIENGESELLSCHAFT (DE) 2005-10-27 WO disclosed