SCHEMBL8996078

SCHEMBL8996078

CCCCOc1cc(C=C(C#N)C(=O)Nc2cccc(Cl)c2)cc(F)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 1/20 0.57
▸ PKM P14618 1/20 0.52
▸ MEN1 O00255 6/20 0.50
▸ KMT2A Q03164 6/20 0.50
▸ MAPT P10636 6/20 0.50
▸ POLB P06746 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ ALPG P10696 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ TP53 P04637 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ PTPN7 P35236 3/20 0.47
▸ PTPN12 Q05209 3/20 0.47
▸ PTPN22 Q9Y2R2 3/20 0.47
▸ BLM P54132 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47
▸ UBA2 Q9UBT2 1/20 0.47

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
SCHEMBL8995992 0.88 FTO (0.61) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996057 0.87 KLK7 (0.61) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996241 0.85 FTO (0.58) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996015 0.84 FTO (0.74) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996059 0.82 KMT2A (0.55) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996055 0.78 KMT2A (0.64) FTOPKMMEN1KMT2AMAPT
SCHEMBL8995999 0.77 EGFR (0.64) FTOPKMMEN1KMT2AMAPT
SCHEMBL8995993 0.77 FTO (0.76) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996019 0.77 FTO (0.76) FTOPKMMEN1KMT2AMAPT
SCHEMBL8996006 0.76 FTO (0.59) FTOPKMMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0537742-B1 Styrene derivatives MITSUBISHI CHEM CORP (JP) 1996-08-21 — — EP disclosed
US-5514711-A ANTICARCINOGENIC AGENTS; SIDE EFFECT REDUCTION MITSUBISHI CHEMICAL CORPORATION (JP) 1996-05-07 — — US disclosed
EP-0537742-A2 Styrene derivatives Mitsubishi Chemical Corporation (JP) 1993-04-21 — — EP disclosed
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