SCHEMBL24512104

SCHEMBL24512104

C=Cc1ccc(C(=O)OC(=O)c2ccc(C(C)CC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 2/20 0.43
▸ TAS1R1 Q7RTX1 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ TSHR P16473 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ NTRK1 P04629 1/20 0.37
▸ NTRK2 Q16620 1/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ESR1 P03372 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
SCHEMBL6659510 0.87 ALDH1A1 (0.53) ALDH1A1TSHRNPSR1MEN1KMT2A
SCHEMBL24512103 0.87 ALDH1A1 (0.53) ALDH1A1TSHRNPSR1MEN1KMT2A
SCHEMBL14565944 0.87 ALDH1A1 (0.47) TAS1R3TAS1R1ALDH1A1TSHRMEN1
SCHEMBL1104206 0.87 ALDH1A1 (0.47) TAS1R3TAS1R1ALDH1A1TSHRMEN1
SCHEMBL411494 0.84 ALDH1A1 (0.48) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL10174225 0.83 TSHR (0.53) ALDH1A1TSHRNPSR1MEN1KMT2A
SCHEMBL24512165 0.83 ALDH1A1 (0.49) ALDH1A1TSHRNPSR1MEN1KMT2A
SCHEMBL716407 0.82 ALDH1A1 (0.48) TAS1R3TAS1R1ALDH1A1TSHRNPSR1
SCHEMBL11517329 0.82 ALDH1A1 (0.48) TAS1R3TAS1R1ALDH1A1TSHRNPSR1
SCHEMBL440528 0.80 ALDH1A1 (0.50) TAS1R3TAS1R1ALDH1A1TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022120478-A1 REACTIVE MICROPARTICLES AND THEIR USE TO PREPARE FUNCTIONAL HYDROGEL PARTICLES ALLARTA LIFE SCIENCE INC. (CA) 2022-06-16 — — WO disclosed
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