SCHEMBL11697221

SCHEMBL11697221

CCCCCCCCCCCCCCCC(=O)Oc1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
PRSS3 P35030 1/20 0.51
ESR1 P03372 3/20 0.50
MEN1 O00255 2/20 0.47
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
PPARA Q07869 1/20 0.46
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
FAAH O00519 4/20 0.44

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
SCHEMBL11697214 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL27214922 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL28361690 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL29466089 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11698316 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11698310 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11698469 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11698463 1.00 KMT2A (0.53) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11813955 0.91 PRSS1 (0.55) KMT2ASMN1; SMN2PRSS1PRSS2PRSS3
SCHEMBL11653472 0.89 KMT2A (0.53) KMT2ASMN1; SMN2MEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-3966900-A INSECTICIDES AIRWICK INDUSTRIES, INC. (US) 1976-06-29 US disclosed