SCHEMBL30383841

SCHEMBL30383841

COc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1COc1ccc(F)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.61
▸ MEN1 O00255 8/20 0.60
▸ KMT2A Q03164 8/20 0.60
▸ ALDH1A1 P00352 4/20 0.60
▸ LMNA P02545 4/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ ABCG2 Q9UNQ0 4/20 0.60
▸ MAPT P10636 3/20 0.60
▸ HPGD P15428 3/20 0.60
▸ TDP1 Q9NUW8 2/20 0.60
▸ TP53 P04637 2/20 0.60
▸ CYP3A4 P08684 2/20 0.60
▸ ALOX15 P16050 2/20 0.60
▸ MAPK1 P28482 2/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ ALOX12 P18054 1/20 0.60
▸ NFKB1 P19838 1/20 0.57
▸ NFKB2 Q00653 1/20 0.57
▸ RELA Q04206 1/20 0.57
▸ CTSL P07711 3/20 0.57

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
SCHEMBL25190979 1.00 CYP19A1 (0.61) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL31233302 0.91 CYP19A1 (0.66) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL25285110 0.91 CYP19A1 (0.66) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL25193206 0.89 MEN1 (0.76) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL25206388 0.88 CYP19A1 (0.62) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL31233327 0.88 CYP19A1 (0.62) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL30382579 0.88 CYP19A1 (0.62) CYP19A1MEN1KMT2AALDH1A1LMNA
SCHEMBL25208719 0.88 MEN1 (0.78) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL30382681 0.88 MEN1 (0.78) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL25214881 0.87 MEN1 (0.71) CYP19A1MEN1KMT2AALDH1A1LMNA

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 — — WO disclosed
EP-4429763-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS Yewsavin, Inc. (US) 2024-09-18 — — EP disclosed
WO-2023086388-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2023-05-19 — — WO disclosed
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