SCHEMBL11633105

SCHEMBL11633105

O=C1Nc2cccc3c(Sc4ccccc4)cc(Sc4ccccc4)c1c23

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ BCL2 P10415 1/20 0.39
▸ TUBB4A P04350 1/20 0.37
▸ TUBB P07437 1/20 0.37
▸ TUBA3C P0DPH7 1/20 0.37
▸ TUBA1B P68363 1/20 0.37
▸ TUBA4A P68366 1/20 0.37
▸ TUBB4B P68371 1/20 0.37
▸ TUBB3 Q13509 1/20 0.37
▸ TUBB2A Q13885 1/20 0.37
▸ TUBB8 Q3ZCM7 1/20 0.37
▸ TUBA3E Q6PEY2 1/20 0.37
▸ TUBA1A Q71U36 1/20 0.37
▸ TUBA1C Q9BQE3 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
SCHEMBL11060440 0.79 BCL2 (0.50) MAPTKDM4ENSD2MAPK1MAOA
SCHEMBL11638611 0.79 MAPT (0.43) ADORA2AMAPTKDM4ENSD2MAPK1
SCHEMBL11809624 0.77 BCL2 (0.50) MAPTKDM4ENSD2MAPK1MAOA
SCHEMBL17045729 0.73 MAOA (0.44) ADORA2AMAPTKDM4ENSD2MAPK1
SCHEMBL11695692 0.70 KDR (0.41) MAPTKDM4EMAOAMAOBBCL2
SCHEMBL9786575 0.69 TUBB4A (0.45) ADORA2AMAPTKDM4ENSD2MAPK1
SCHEMBL10949405 0.67 KDR (0.40) MAPTKDRMEN1KMT2ACDK2
SCHEMBL52296 0.67 KDM4E (0.62) ADORA2AMAPTKDM4ENSD2MAPK1
SCHEMBL10956537 0.67 CES1 (0.47) KDM4EKDRCDK2CCNB2CCNE2
SCHEMBL11674909 0.67 BCL2 (0.59) MAPTKDM4ENSD2MAPK1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4096145-A DYES FOR RESINS AND POLYESTER TEXTILES BASF AKTIENGESELLSCHAFT (DT) 1978-06-20 — — US disclosed
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