SCHEMBL20917036

SCHEMBL20917036

C=C(C)C(C)(C)C(=O)/C=C(/C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DEGS1 O15121 1/20 0.43
▸ NR4A1 P22736 1/20 0.40
▸ NR4A2 P43354 1/20 0.40
▸ NR4A3 Q92570 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CES2 O00748 2/20 0.38
▸ CES1 P23141 2/20 0.38
▸ AKT1 P31749 1/20 0.37
▸ ATM Q13315 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ XBP1 P17861 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36
▸ NFE2L2 Q16236 1/20 0.36

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
SCHEMBL20917037 1.00 DEGS1 (0.43) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL20917231 1.00 DEGS1 (0.43) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL10716767 0.77 DEGS1 (0.46) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL5858029 0.77 NR4A1 (0.51) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL5858034 0.77 NR4A1 (0.51) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL20917112 0.76 CES1 (0.48) SMN1; SMN2LMNACES2CES1AKT1
Hydrochloric Acid SCHEMBL11760666 0.75 NR4A2 (0.58) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL6930945 0.74 DEGS1 (0.47) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL582234 0.73 NR4A2 (0.60) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL691911 0.73 NR4A2 (0.60) DEGS1NR4A1NR4A2NR4A3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3697878-A1 ODORANTS AND COMPOSITIONS COMPRISING ODORANTS S. H. Kelkar&Company Pvt. Ltd. (IN) 2020-08-26 — — EP disclosed
EP-3697877-A1 ODORANTS AND COMPOSITIONS COMPRISING ODORANTS S. H. Kelkar&Company Pvt. Ltd. (IN) 2020-08-26 — — EP disclosed
WO-2019076933-A1 ODORANTS AND COMPOSITIONS COMPRISING ODORANTS S H KELKAR & COMPANY LIMITED (IN) 2019-04-25 — — WO disclosed
WO-2019076926-A1 ODORANTS AND COMPOSITIONS COMPRISING ODORANTS S H KELKAR & COMPANY LIMITED (IN) 2019-04-25 — — WO disclosed
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