SCHEMBL6151503

SCHEMBL6151503

CO[C](OC)C(=Cc1ccccc1)OC

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.47
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
AKR1C3 P42330 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RECQL P46063 1/20 0.40
CMA1 P23946 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
FBP1 P09467 1/20 0.38
NR1I2 O75469 1/20 0.38
TRPA1 O75762 1/20 0.38
AKR1C1 Q04828 1/20 0.36
ESR1 P03372 1/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL11243856 1.00 ABCG2 (0.47) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL11877949 0.82 AKR1C3 (0.52) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL6262041 0.81 AKR1C3 (0.55) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL9103420 0.81 ABCG2 (0.54) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL3818255 0.81 AKR1C3 (0.55) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL3485765 0.81 AKR1C3 (0.55) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL83065 0.81 AKR1C3 (0.55) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL5047540 0.79 RECQL (0.55) ABCG2ALDH1A1TSHRAKR1C3MEN1
SCHEMBL8351839 0.79 AKR1C3 (0.53) ABCG2ALDH1A1TSHRAKR1C3MEN1
Hydrochloric Acid SCHEMBL10437231 0.79 AKR1C3 (0.53) ABCG2ALDH1A1TSHRAKR1C3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6656510-B2 Antidepressants INDENA S.P.A. (IT) 2003-12-02 US claimed
US-20010020040-A1 Hyperforin derivatives, use thereof and formulations containing them INDENA S.P.A. (IT) 2001-09-06 US claimed
EP-1086071-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.p.A. (IT) 2001-03-28 EP claimed
WO-1999064388-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.P.A. (IT) 1999-12-16 WO claimed
JP-57032255-A None JP disclosed
EP-1607099-A1 Use of hyperforin derivatives as an antidepressant agent INDENA S.p.A. (IT) 2005-12-21 EP disclosed
US-6656510-B2 Antidepressants INDENA S.P.A. (IT) 2003-12-02 US disclosed
US-20010020040-A1 Hyperforin derivatives, use thereof and formulations containing them INDENA S.P.A. (IT) 2001-09-06 US disclosed
EP-1086071-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.p.A. (IT) 2001-03-28 EP disclosed
WO-1999064388-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.P.A. (IT) 1999-12-16 WO disclosed
JP-S5732255-A TRIMETHOXYPHENYL DERIVATIVE KOWA CO 1982-02-20 JP 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-20010020040-A1 Hyperforin derivatives, use thereof and formulations containing them CRH, FOS, VIP ABCG2 1183/4885ALDH1A1 2180/4885TSHR 3026/4885

“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.