SCHEMBL21377201

SCHEMBL21377201

CCCC(C)NSC1=Cc2ccccc2C1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.33
NAMPT P43490 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ACHE P22303 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
PTGS2 P35354 1/20 0.31
CYP11B2 P19099 1/20 0.30

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
SCHEMBL19370719 0.70 SMN1; SMN2 (0.46) SMN1; SMN2POLBMTNR1AMTNR1BMAOA
SCHEMBL7196687 0.68 SOAT1 (0.39) MTNR1AMTNR1BACHENPC1RAB9A
SCHEMBL7199649 0.67 PTGS2 (0.41) MTNR1AMTNR1BMAOAMAOBACHE
SCHEMBL27397679 0.66 TRPA1 (0.42) MTNR1AMTNR1BMAOAMAOBACHE
SCHEMBL23192186 0.65 SIGMAR1 (0.42) MTNR1AMTNR1BACHE
SCHEMBL4721993 0.64 SMN1; SMN2 (0.37) SMN1; SMN2POLBNPC1RAB9ACA12
SCHEMBL28478574 0.63 MAOA (0.43) MTNR1AMTNR1BMAOAMAOBACHE
SCHEMBL21694413 0.63 ACHE (0.49) MTNR1AMTNR1BMAOAMAOBACHE
SCHEMBL15701697 0.63 ACHE (0.42) SMN1; SMN2MTNR1AMTNR1BMAOAACHE
SCHEMBL7191958 0.61 MAOA (0.41) SMN1; SMN2MAOAMAOBACHEPTGS2

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
EP-3101015-B1 HETEROCYCLIC SULFONAMIDE DERIVATIVE AND MEDICINE COMPRISING SAME EA PHARMA CO LTD (JP) 2019-09-18 EP disclosed