SCHEMBL11743527

SCHEMBL11743527

CCOc1ccc(-c2nnc(N(C(C)C)C(C)C)nc2-c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ CACNA2D1 P54289 4/20 0.38
▸ TP53 P04637 4/20 0.38
▸ MAOB P27338 1/20 0.37
▸ ACACB O00763 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL11751925 0.86 CACNA2D1 (0.47) MAPTCACNA2D1TP53LMNAALDH1A1
SCHEMBL11749749 0.85 MAPT (0.40) MAPTTP53LMNAALDH1A1KDM4E
SCHEMBL11751106 0.83 TP53 (0.45) MAPTCACNA2D1TP53LMNAALDH1A1
SCHEMBL10940970 0.81 ALDH1A1 (0.44) MAPTCACNA2D1TP53MAOBLMNA
SCHEMBL11467756 0.80 CACNA2D1 (0.44) MAPTCACNA2D1TP53LMNAALDH1A1
SCHEMBL11750266 0.78 CACNA2D1 (0.46) MAPTCACNA2D1TP53LMNAALDH1A1
SCHEMBL11745628 0.77 ALDH1A1 (0.45) MAPTMAOBLMNAALDH1A1MEN1
SCHEMBL11741147 0.76 MAPT (0.44) MAPTCACNA2D1TP53LMNAALDH1A1
SCHEMBL11244627 0.74 ADK (0.38) MAPTALDH1A1MEN1KMT2AHTT
SCHEMBL11745512 0.73 MAPT (0.44) MAPTTP53LMNAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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