SCHEMBL29593151

SCHEMBL29593151

CC(C)(C)NC[C@H](O)c1ccc(F)c2c1cnn2COCC[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F2RL1 P55085 1/20 0.40
▸ ADRB1 P08588 3/20 0.33
▸ ADRB2 P07550 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ DGAT1 O75907 1/20 0.31

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
SCHEMBL28722165 1.00 F2RL1 (0.40) F2RL1ADRB1ADRB2CYP2D6NFKB1
SCHEMBL24631038 1.00 F2RL1 (0.40) F2RL1ADRB1ADRB2CYP2D6NFKB1
SCHEMBL28724403 0.86 F2RL1 (0.43) F2RL1DGAT1
SCHEMBL29594153 0.86 F2RL1 (0.43) F2RL1DGAT1
SCHEMBL24631037 0.86 F2RL1 (0.43) F2RL1DGAT1
SCHEMBL1957623 0.76 F2RL1 (0.39) F2RL1DGAT1
SCHEMBL28722129 0.76 F2RL1 (0.39) F2RL1
SCHEMBL22864283 0.75 ADRB2 (0.35) F2RL1ADRB1ADRB2CYP2D6NFKB1
SCHEMBL22864153 0.74 DGAT1 (0.39) F2RL1DGAT1
SCHEMBL29593705 0.74 DGAT1 (0.39) F2RL1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3993878-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME Curasen Therapeutics, Inc. (US) 2022-05-11 — — EP disclosed
CN-114340740-A Beta adrenergic agonists and methods of use thereof 库拉森疗法公司 2022-04-12 — — CN disclosed
Send feedback