SCHEMBL7090065

SCHEMBL7090065

Cc1cc(C)c2c(c1)OC(=O)C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.43
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TSHR P16473 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.32
▸ CA1 P00915 3/20 0.31
▸ CA2 P00918 2/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MMP9 P14780 1/20 0.31
▸ MMP8 P22894 1/20 0.31
▸ MMP13 P45452 1/20 0.31
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31

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
SCHEMBL7092464 0.71 MAPT (0.38) CYP19A1MEN1NPC1USP2POLB
SCHEMBL4117969 0.70 TDP1 (0.39) CYP19A1MEN1USP2POLBKMT2A
SCHEMBL30971010 0.70 TDP1 (0.39) CYP19A1MEN1USP2POLBKMT2A
SCHEMBL12229114 0.68 TSHR (0.36) CYP19A1MEN1KMT2ATSHRADORA3
SCHEMBL30544624 0.67 GRIN2D (0.38) MAOAMAOBGRIN2DGRIN3BGRIN1
SCHEMBL9282920 0.67 TSHR (0.44) CYP19A1NPC1KMT2ATSHRCA1
SCHEMBL6904482 0.66 ELANE (0.45) MEN1NPC1USP2POLBKMT2A
SCHEMBL12111227 0.66 ELANE (0.50) MEN1NPC1USP2POLBKMT2A
SCHEMBL6036547 0.66 ELANE (0.45) MEN1NPC1USP2POLBKMT2A
4,6-Dimethylcoumaranone SCHEMBL7195838 0.65 TSHR (0.46) TSHRHSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112939917-B Preparation method of flavonoid compound 中山大学 2023-08-22 — — CN disclosed
CN-112939917-A Preparation method of flavonoid compound 中山大学 2021-06-11 — — CN disclosed
US-20030121113-A1 Oxobenzofuranylide-dihydroindolone NESVADBA PETER (CH) 2003-07-03 — — US disclosed
US-6503937-B1 Coloring agents for high molecular weight materials such as polymers CIBA SPECIALTY CHEMICALS CORPORATION 2003-01-07 — — 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-20030121113-A1 Oxobenzofuranylide-dihydroindolone CYP1B1, CYP1A1, ECI1 CYP19A1 81/4885MEN1 516/4885NPC1 2435/4885

“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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