SCHEMBL11706189

SCHEMBL11706189

CSc1nnc(NC(=O)N(C)N)s1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.52
▸ ALDH1A1 P00352 6/20 0.50
▸ NPC1 O15118 5/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ NTSR1 P30989 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA4 P22748 1/20 0.49
▸ CA5A P35218 1/20 0.49
▸ CA5B Q9Y2D0 1/20 0.49
▸ MAPT P10636 4/20 0.44
▸ G6PD P11413 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL11372313 0.87 RAB9A (0.55) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL10567054 0.83 RAB9A (0.51) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL8779354 0.78 RAB9A (0.59) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL10567480 0.77 RAB9A (0.46) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL18542003 0.76 RAB9A (0.58) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL11706117 0.74 SMN1; SMN2 (0.58) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL997655 0.74 RAB9A (0.67) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL11707125 0.73 HTT (0.55) RAB9ANPC1SMN1; SMN2POLBCA1
SCHEMBL12354891 0.72 RAB9A (0.58) RAB9AALDH1A1NPC1SMN1; SMN2POLB
SCHEMBL11555602 0.71 RAB9A (0.46) RAB9AALDH1A1NPC1SMN1; SMN2POLB

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-4007031-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1977-02-08 — — US disclosed
US-3931209-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-01-06 — — US disclosed
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