SCHEMBL11554281

SCHEMBL11554281

Cc1ccc(C(=S)Nc2nnn[nH]2)c(O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.38
▸ PLG P00747 3/20 0.36
▸ KLK1 P06870 2/20 0.36
▸ KLK6 Q92876 2/20 0.36
▸ F2 P00734 1/20 0.36
▸ F10 P00742 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ PLAT P00750 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.35
▸ TAS1R1 Q7RTX1 1/20 0.35
▸ TAS1R2 Q8TE23 1/20 0.35
▸ ALOX15 P16050 1/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33

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
SCHEMBL11559697 0.89 GRM5 (0.39) F2F10PLAUPLATNPC1
SCHEMBL11564423 0.86 KDR (0.49) KDRPLGKLK1KLK6F2
SCHEMBL11562452 0.75 ALDH1A1 (0.38) KDRPLGKLK1F2F10
SCHEMBL11559423 0.75 GRM5 (0.51) KDRF2F10PLAUPLAT
SCHEMBL11565071 0.71 ALDH1A1 (0.49) RAB9AALOX15LMNAMAPTHTT
SCHEMBL11557569 0.69 PNLIP (0.40) NPC1RAB9ATAS1R3TAS1R1TAS1R2
SCHEMBL11564078 0.69 P2RX1 (0.48) PLGF2F10PLAUPLAT
SCHEMBL11559729 0.69 KLKB1 (0.51) NPC1RAB9ATAS1R3TAS1R1ALOX15
SCHEMBL11556748 0.69 SMN1; SMN2 (0.51) PLGKLK1KLK6NPC1RAB9A
SCHEMBL11554274 0.69 SMN1; SMN2 (0.43) NPC1RAB9AALOX15LMNAMAPT

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-4146631-A ANTIALLERGENS, RESPIRATORY DISORDERS MAY & BAKER LIMITED (GB) 1979-03-27 — — US disclosed
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