SCHEMBL14523859

SCHEMBL14523859

CC1(C)Oc2c(C(=O)/C=C/c3ccc(O)cc3)ccc(O)c2CC1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.47
▸ BACE1 P56817 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ ODC1 P11926 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ MEN1 O00255 5/20 0.46
▸ KMT2A Q03164 5/20 0.46
▸ CYP3A4 P08684 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ HPGD P15428 4/20 0.46
▸ ALOX15 P16050 4/20 0.46
▸ MAPK1 P28482 4/20 0.46
▸ NFKB1 P19838 3/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ TP53 P04637 3/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ CHRNA7 P36544 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ AKR1B1 P15121 2/20 0.46

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
SCHEMBL5997891 0.87 MAOB (0.52) PTPN1BACE1BCHEODC1ACHE
SCHEMBL14523845 0.87 MAOB (0.52) PTPN1BACE1BCHEODC1ACHE
SCHEMBL4982221 0.84 PTPN1 (0.51) PTPN1BACE1BCHEODC1ACHE
SCHEMBL5519370 0.84 PTPN1 (0.51) PTPN1BACE1BCHEODC1ACHE
SCHEMBL4977898 0.83 OSBP (0.43) PTPN1BACE1BCHEODC1ACHE
SCHEMBL4977891 0.83 OSBP (0.43) PTPN1BACE1BCHEODC1ACHE
SCHEMBL15620334 0.80 NFKB1 (0.48) PTPN1BACE1BCHEODC1ACHE
SCHEMBL30834905 0.79 NFKB1 (0.53) MEN1KMT2ACYP3A4MAPTHPGD
SCHEMBL14518094 0.77 MAOB (0.45) PTPN1MEN1KMT2AMAPTMAPK1
SCHEMBL14201287 0.76 MAOB (0.43) KMT2AMAPTMAPK1MAOAMAOB

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
US-20070092551-A1 Therapeutic agent TAKARA BIO INC. (JP) 2007-04-26 — — US disclosed
US-20070092551-A1 Therapeutic agent TAKARA BIO INC. (JP) 2007-04-26 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070092551-A1 Therapeutic agent FABP4, GPR119, IAPP PTPN1 1950/4885BACE1 2913/4885BCHE 2205/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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