SCHEMBL9350414

SCHEMBL9350414

c1nc(C2CCCCCCCCCCC2)c(C2CCCCCCCCCCC2)nc1C1CCCCCCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
ATR Q13535 1/20 0.38
ABL1 P00519 1/20 0.36
KMO O15229 1/20 0.36
HRH4 Q9H3N8 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
LCK P06239 1/20 0.34
CYP11B2 P19099 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
HIF1A Q16665 1/20 0.33
TDO2 P48775 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
JAK3 P52333 1/20 0.32
PTGS2 P35354 2/20 0.32
CTSK P43235 3/20 0.32

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
SCHEMBL3101453 1.00 L3MBTL1 (0.42) L3MBTL1ATRABL1KMOHRH4
SCHEMBL24890965 0.82 ATR (0.48) L3MBTL1ATRABL1KMOHRH4
SCHEMBL24890808 0.82 ATR (0.48) L3MBTL1ATRABL1KMOHRH4
SCHEMBL19333209 0.78 L3MBTL1 (0.35) L3MBTL1ATRABL1KMOTDP1
SCHEMBL21013748 0.78 L3MBTL1 (0.35) L3MBTL1ATRABL1KMOTDP1
SCHEMBL19069492 0.78 TDO2 (0.39) L3MBTL1HRH4TDP1LCKCYP11B2
SCHEMBL21306241 0.74 ALDH1A1 (0.41) L3MBTL1TDP1LCKCYP11B2KDM4E
SCHEMBL2355700 0.72 CYP11B2 (0.40) L3MBTL1KMOTDP1CYP11B2SMN1; SMN2
SCHEMBL3843486 0.71 PDE10A (0.33) SMN1; SMN2KMT2AJAK2JAK1JAK3
SCHEMBL29184273 0.71 L3MBTL1 (0.45) L3MBTL1ATRTDP1LCKSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10414855-B2 Multifunctional polyamides for protective coatings HUNTSMAN ADVANCED MATERIALS AMERICAS LLC (US) 2019-09-17 US disclosed
EP-3143067-A1 MULTIFUNCTIONAL POLYAMIDES FOR PROTECTIVE COATINGS Huntsman Advanced Materials Americas LLC (US) 2017-03-22 EP disclosed
US-20170051100-A1 MULTIFUNCTIONAL POLYAMIDES FOR PROTECTIVE COATINGS HUNTSMAN ADVANCED MATERIALS AMERICAS LLC 2017-02-23 US disclosed
WO-2015175583-A1 MULTIFUNCTIONAL POLYAMIDES FOR PROTECTIVE COATINGS HUNTSMAN ADVANCED MATERIALS AMERICAS LLC (US) 2015-11-19 WO disclosed
US-5319004-A Good water resistance HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-07 US disclosed
US-5017675-A Flexibility HOECHST AG (DE) 1991-05-21 US disclosed