SCHEMBL24339049

SCHEMBL24339049

O=C(OI)c1cnccc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ SIRT3 Q9NTG7 1/20 0.38
▸ KMT2A Q03164 3/20 0.37
▸ HTT P42858 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ KDM6B O15054 1/20 0.35
▸ KDM4A O75164 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ KDM4D Q6B0I6 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CDC7 O00311 1/20 0.34

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
SCHEMBL3731616 0.81 TDP1 (0.42) L3MBTL1ALDH1A1KDM4EGAAGLA
SCHEMBL3889500 0.79 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4EGAAGLA
SCHEMBL229353 0.76 KDM4C (0.53) L3MBTL1ALDH1A1KDM4EGAATDP1
SCHEMBL30316868 0.76 KDM4C (0.53) L3MBTL1ALDH1A1KDM4EGAATDP1
SCHEMBL1135627 0.75 SIRT3 (0.60) L3MBTL1ALDH1A1KDM4ETDP1SIRT3
SCHEMBL2579028 0.75 ALDH1A1 (0.52) L3MBTL1ALDH1A1KDM4EGAAGLA
SCHEMBL30849093 0.75 TDP1 (0.46) L3MBTL1ALDH1A1KDM4EGAAGLA
SCHEMBL16414200 0.75 TDP1 (0.46) L3MBTL1ALDH1A1KDM4EGAAGLA
SCHEMBL24288684 0.72 CES2 (0.58) ALDH1A1GAATDP1KMT2AMEN1
SCHEMBL25236818 0.69 L3MBTL1 (0.40) L3MBTL1ALDH1A1KDM4EGAAGLA

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
EP-3183236-B1 METHOD FOR THE PRODUCTION OF 18F-LABELED ACTIVE ESTERS AND THEIR APPLICATION EXEMPLIFIED BY THE PREPARATION OF A PSMA-SPECIFIC PET-TRACER MAX PLANCK GESELLSCHAFT ZUR FOERDERUNG DER WSS (DE) 2022-04-20 — — EP disclosed
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