SCHEMBL8412982

SCHEMBL8412982

ClC(Cl)(Cl)c1nc(-c2ccc(-c3nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n3)cc2)nc(C(Cl)(Cl)Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HTT P42858 1/20 0.32
CCNB2 O95067 1/20 0.32
CCNE2 O96020 1/20 0.32
CDK1 P06493 1/20 0.32
CDK4 P11802 1/20 0.32
CCNB1 P14635 1/20 0.32
CCNA2 P20248 1/20 0.32
CCND1 P24385 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
CCNA1 P78396 1/20 0.32
CCNB3 Q8WWL7 1/20 0.32
POLB P06746 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 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
SCHEMBL80044 0.91 NPC1 (0.52) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL125466 0.89 MEN1 (0.44) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL126470 0.89 RAB9A (0.37) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL80269 0.89 NPC1 (0.41) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL130297 0.89 NR1H4 (0.39) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL8607879 0.89 MEN1 (0.48) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL306970 0.89 MEN1 (0.46) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL125517 0.89 NPC1 (0.50) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL22129836 0.89 NPC1 (0.41) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL80527 0.88 MEN1 (0.47) NPC1RAB9AMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519299-B1 Positive-working radiation-sensitive composition and radiation-sensitive recording material produced therewith CLARIANT GMBH (DE) 1999-08-11 EP disclosed
US-5364734-A Sulfonated triazines HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-15 US disclosed
EP-0519298-A1 Radiation-sensitive sulfonic acid esters and their use HOECHST AKTIENGESELLSCHAFT (DE) 1992-12-23 EP disclosed
EP-0519299-A1 Positive-working radiation-sensitive composition and radiation-sensitive recording material produced therewith HOECHST AKTIENGESELLSCHAFT (DE) 1992-12-23 EP disclosed