SCHEMBL10362865

SCHEMBL10362865

COC(=O)c1ccccc1NC(=O)C(N)CCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ GAA P10253 2/20 0.53
▸ KDM4E B2RXH2 7/20 0.53
▸ ALDH1A1 P00352 6/20 0.53
▸ LTA4H P09960 2/20 0.53
▸ HSD17B10 Q99714 4/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ LNPEP Q9UIQ6 2/20 0.49
▸ ERAP2 Q6P179 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ ALOX15 P16050 1/20 0.48

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
Dimethyl Phthalate SCHEMBL28111561 0.82 GRM8 (0.55) TSHRALDH1A1LTA4HHSD17B10CYP1A2
SCHEMBL176835 0.79 NPC1 (0.51) KDM4EALDH1A1LTA4HHSD17B10HPGD
SCHEMBL176836 0.79 NPC1 (0.51) KDM4EALDH1A1LTA4HHSD17B10HPGD
SCHEMBL25904137 0.79 TSHR (0.65) TSHRTDP1KMT2AGAAKDM4E
SCHEMBL28447277 0.78 LTA4H (0.49) LTA4HCYP1A2LNPEPERAP2L3MBTL1
SCHEMBL6715728 0.78 TSHR (0.60) TSHRTDP1KMT2AGAAKDM4E
SCHEMBL28304178 0.78 TSHR (0.60) TSHRTDP1KMT2AGAAKDM4E
SCHEMBL14426829 0.77 KDM4E (0.74) TSHRTDP1KMT2AGAAKDM4E
SCHEMBL10362634 0.77 TSHR (0.56) TSHRTDP1KMT2AGAAKDM4E
SCHEMBL10364418 0.77 GAA (0.69) TSHRKMT2AGAAKDM4EALDH1A1

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
EP-0147211-B1 4H-3,1-BENZOXAZIN-4-ONES AND RELATED COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION SYNTEX (U.S.A.) INC. (US) 1990-09-12 — — EP disclosed
US-4657893-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1987-04-14 — — US disclosed
EP-0147211-A2 4H-3,1-benzoxazin-4-ones and related compounds, pharmaceutical compositions containing them, and processes for their preparation SYNTEX (U.S.A.) INC. (US) 1985-07-03 — — EP disclosed
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