SCHEMBL8996037

SCHEMBL8996037

N#CC(=Cc1ccc(O)c(O)c1)C(=O)Nc1cccc(Cl)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 12/20 0.76
▸ ERBB2 P04626 5/20 0.76
▸ MEN1 O00255 3/20 0.76
▸ KMT2A Q03164 3/20 0.76
▸ PKM P14618 2/20 0.76
▸ TP53 P04637 2/20 0.76
▸ SMN1; SMN2 Q16637 2/20 0.76
▸ ALDH1A1 P00352 2/20 0.76
▸ MAPT P10636 2/20 0.76
▸ MAPK1 P28482 2/20 0.76
▸ KDM4E B2RXH2 1/20 0.76
▸ PSMD14 O00487 1/20 0.76
▸ RGS12 O14924 1/20 0.76
▸ GMNN O75496 1/20 0.76
▸ LMNA P02545 1/20 0.76
▸ CYP1A2 P05177 1/20 0.76
▸ CYP3A4 P08684 1/20 0.76
▸ CYP2D6 P10635 1/20 0.76
▸ HPGD P15428 1/20 0.76
▸ ALOX15 P16050 1/20 0.76

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
SCHEMBL8996038 0.86 EGFR (0.77) EGFRERBB2MEN1KMT2APKM
SCHEMBL1704988 0.86 EGFR (1.00) EGFRERBB2MEN1KMT2APKM
SCHEMBL29766990 0.86 EGFR (1.00) EGFRERBB2MEN1KMT2APKM
SCHEMBL30555674 0.86 EGFR (1.00) EGFRERBB2MEN1KMT2APKM
SCHEMBL5909179 0.86 EGFR (1.00) EGFRERBB2MEN1KMT2APKM
SCHEMBL8995993 0.86 FTO (0.76) EGFRERBB2MEN1KMT2APKM
SCHEMBL8996019 0.86 FTO (0.76) EGFRERBB2MEN1KMT2APKM
SCHEMBL8995995 0.86 EGFR (0.76) EGFRERBB2MEN1KMT2APKM
SCHEMBL8996074 0.86 EGFR (0.76) EGFRERBB2MEN1KMT2APKM
SCHEMBL8996015 0.85 FTO (0.74) EGFRERBB2MEN1KMT2APKM

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
Send feedback