SCHEMBL30384556

SCHEMBL30384556

CC1(C)CCc2cc(/C=C/C(=O)c3ccc(O)cc3O)ccc2O1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.60
▸ KMT2A Q03164 7/20 0.54
▸ MEN1 O00255 6/20 0.54
▸ CYP3A4 P08684 5/20 0.54
▸ MAPT P10636 5/20 0.54
▸ NFKB1 P19838 4/20 0.54
▸ TDP1 Q9NUW8 4/20 0.54
▸ HPGD P15428 4/20 0.54
▸ ALOX15 P16050 4/20 0.54
▸ MAPK1 P28482 4/20 0.54
▸ NFKB2 Q00653 3/20 0.54
▸ RELA Q04206 3/20 0.54
▸ TP53 P04637 3/20 0.54
▸ HSD17B10 Q99714 3/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ AKR1B1 P15121 2/20 0.54
▸ HSD17B2 P37059 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ GMNN O75496 1/20 0.54

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
SCHEMBL25200700 1.00 PTPN1 (0.60) PTPN1KMT2AMEN1CYP3A4MAPT
SCHEMBL25254874 0.77 ABCG2 (0.55) KMT2AMEN1CYP3A4MAPTNFKB1
SCHEMBL22038894 0.75 ATM (0.51) KMT2AMEN1CYP3A4MAPTTDP1
SCHEMBL3184205 0.75 AKT1 (0.56) MAPTTDP1ESR1ESR2PKM
SCHEMBL30513267 0.75 AKT1 (0.56) MAPTTDP1ESR1ESR2PKM
SCHEMBL30383083 0.75 PTPN1 (1.00) PTPN1KMT2AMEN1CYP3A4MAPT
SCHEMBL16867661 0.74 ABCG2 (0.61) KMT2AMEN1CYP3A4MAPTHPGD
SCHEMBL847088 0.74 ALOX5 (0.52) CYP3A4MAPTHPGDAPPBACE1
SCHEMBL847089 0.74 ALOX5 (0.52) CYP3A4MAPTHPGDAPPBACE1
SCHEMBL25241260 0.74 MAPT (0.66) PTPN1KMT2AMEN1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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