SCHEMBL11559697

SCHEMBL11559697

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.39
▸ CSNK2A1 P68400 1/20 0.38
▸ P2RX1 P51575 1/20 0.34
▸ TMPRSS4 Q9NRS4 1/20 0.34
▸ LMNA P02545 4/20 0.34
▸ MAPT P10636 4/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ RAB9A P51151 5/20 0.33
▸ HPGD P15428 3/20 0.33
▸ HTT P42858 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ PLAU P00749 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL11554281 0.89 KDR (0.38) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL11559423 0.83 GRM5 (0.51) GRM5CSNK2A1P2RX1TMPRSS4LMNA
SCHEMBL11564423 0.78 KDR (0.49) GRM5LMNAMAPTKDM4EMEN1
SCHEMBL11562452 0.75 ALDH1A1 (0.38) P2RX1LMNAMAPTKDM4EKMT2A
SCHEMBL10877859 0.71 NPC1 (0.40) GRM5MAPTHTTPLAUF2
SCHEMBL11761064 0.69 CYP1A2 (0.56) GRM5MAPTMEN1KMT2AALDH1A1
SCHEMBL11562472 0.69 P2RX1 (0.46) P2RX1TMPRSS4LMNAKDM4EMEN1
SCHEMBL11105640 0.68 KDM4E (0.60) LMNAKDM4EMEN1KMT2AALDH1A1
SCHEMBL10880124 0.68 ALDH1A1 (0.48) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL11562495 0.68 HSP90AA1 (0.38) GRM5P2RX1TMPRSS4MAPTKDM4E

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