SCHEMBL28728490

SCHEMBL28728490

O=C(Nc1ccccc1)N(C1CCCCC1)C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.62
▸ RAB9A P51151 4/20 0.52
▸ POLB P06746 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ HPGD P15428 1/20 0.50
▸ MAPT P10636 2/20 0.49
▸ EPHX2 P34913 2/20 0.48
▸ EPHX1 P07099 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 2/20 0.47
▸ GAA P10253 2/20 0.43
▸ ABCC1 P33527 1/20 0.43
▸ NPY5R Q15761 1/20 0.43
▸ NPC1 O15118 1/20 0.43

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
SCHEMBL27935313 0.82 LMNA (0.50) ATMRAB9APOLBHPGDMAPT
SCHEMBL10595718 0.80 ATM (0.71) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL7620949 0.78 ATM (0.69) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL7614096 0.78 ATM (0.69) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL11599130 0.77 ATM (1.00) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL28798411 0.77 ATM (0.68) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL7613507 0.76 ATM (0.67) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL9547525 0.76 ATM (0.66) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL13900772 0.73 ATM (0.62) ATMRAB9APOLBALDH1A1HPGD
SCHEMBL10337815 0.72 DCUN1D1 (0.63) ALDH1A1

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-114276524-A Preparation method of high-molecular-weight degradable recyclable polyester containing double-bond side groups 青岛科技大学 2022-04-05 — — CN disclosed
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