SCHEMBL11484277

SCHEMBL11484277

COc1ccc(-c2nnc(S)nc2-c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ APP P05067 4/20 0.49
▸ SLC2A1 P11166 1/20 0.45
▸ ADK P55263 1/20 0.44
▸ RAD51 Q06609 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ KDM1A O60341 1/20 0.43
▸ AURKA O14965 1/20 0.41
▸ PTGES O14684 3/20 0.41
▸ PTGDR Q13258 1/20 0.41
▸ GPR84 Q9NQS5 1/20 0.41

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
SCHEMBL11483878 1.00 KDM4E (0.54) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL10820279 0.89 ALDH1A1 (0.51) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL11742675 0.89 MAPT (0.42) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL396506 0.84 MAPT (0.55) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL29717679 0.84 MAPT (0.55) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL11745048 0.84 ALDH1A1 (0.55) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL11872551 0.82 MAPT (0.54) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL2329060 0.82 ADORA1 (0.56) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL11714741 0.82 ALOX5 (0.46) ALDH1A1MAPTHSD17B10APPGLA
Hydrazine SCHEMBL28832608 0.81 MAPT (0.52) KDM4EALDH1A1MAPTHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4190725-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1980-02-26 — — US disclosed
US-4021553-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-05-03 — — US disclosed
US-4018923-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-04-19 — — US disclosed
US-4013654-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1977-03-22 — — US disclosed
US-4008232-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1977-02-15 — — US disclosed
US-3979516-A Anti-inflammatory 3-amino-5,6-diaryl-1,2,4-triazines ELI LILLY AND COMPANY (US) 1976-09-07 — — US disclosed
US-3948894-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1976-04-06 — — US disclosed
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