SCHEMBL10639734

SCHEMBL10639734

CC(C)(C)OC(=O)C=CC1(O)CCN(C(=O)OCc2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ GPR4 P46093 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL10639160 0.82 SMN1; SMN2 (0.47) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL10805588 0.82 ALDH1A1 (0.44) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL5724167 0.82 ALDH1A1 (0.67) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL10639423 0.77 ALDH1A1 (0.44) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL27640500 0.75 SMN1; SMN2 (0.46) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL10639506 0.75 ALDH1A1 (0.49) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL8587397 0.74 ALDH1A1 (0.56) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9519331 0.74 ALDH1A1 (0.56) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL10639622 0.74 SMN1; SMN2 (0.46) ALDH1A1MAPTLMNASMN1; SMN2KMT2A
SCHEMBL6046664 0.73 ALDH1A1 (0.52) ALDH1A1MAPTLMNASMN1; SMN2KMT2A

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-4742052-A Antibacterial β-lactam compounds SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-05-03 — — US disclosed
EP-0070204-B1 CARBOXYLIC BETA-LACTAM COMPOUNDS AND THE PREPARATION THEREOF SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-11-19 — — EP disclosed
EP-0070204-A2 Carboxylic beta-lactam compounds and the preparation thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1983-01-19 — — EP disclosed
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