SCHEMBL28184652

SCHEMBL28184652

CC(=O)C(=O)CC(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.50
▸ SCN3A Q9NY46 1/20 0.49
▸ HPGD P15428 4/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ POLB P06746 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ AOC3 Q16853 1/20 0.47
▸ TAAR1 Q96RJ0 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ TRPA1 O75762 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ LMNA P02545 1/20 0.46

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
SCHEMBL2782422 0.86 FFAR1 (0.51) FFAR1SCN3AHPGDRAB9ACYP3A4
SCHEMBL11484603 0.83 FFAR1 (0.53) FFAR1SCN3AHPGDRAB9ACYP3A4
SCHEMBL1149358 0.83 FFAR1 (0.53) FFAR1SCN3AHPGDRAB9ACYP3A4
SCHEMBL1149769 0.83 FFAR1 (0.53) FFAR1SCN3AHPGDRAB9ACYP3A4
SCHEMBL11142933 0.82 FFAR1 (0.49) FFAR1SCN3AHPGDRAB9ACYP3A4
Acetic Acid SCHEMBL159740 0.82 FFAR1 (0.66) FFAR1SCN3AHPGDRAB9ACYP3A4
SCHEMBL237091 0.81 FFAR1 (0.70) FFAR1HPGDRAB9ACYP3A4CYP2C19
SCHEMBL237090 0.81 FFAR1 (0.70) FFAR1HPGDRAB9ACYP3A4CYP2C19
SCHEMBL7398650 0.81 ACHE (0.60) FFAR1HPGDRAB9ACYP3A4CYP2C19
SCHEMBL1149768 0.81 FFAR1 (0.70) FFAR1HPGDRAB9ACYP3A4CYP2C19

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
CN-107615104-A Light-blocking member, black-colored resin composition and black resin formed products 木本股份有限公司 2018-01-19 — — CN disclosed
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