SCHEMBL6770157

SCHEMBL6770157

CC(C)Oc1cccc2c1C(=O)c1ccccc1C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.50
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CES1 P23141 2/20 0.43
BCHE P06276 1/20 0.43
ALDH1A1 P00352 8/20 0.43
KDM4E B2RXH2 6/20 0.43
MAPT P10636 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
USP2 O75604 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
DUSP3 P51452 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL6906412 0.83 ALDH1A1 (0.58) MAOACA1CA2CA7CA9
SCHEMBL11702867 0.80 CA1 (0.60) MAOACA1CA2CA7CA9
SCHEMBL28384518 0.80 MAOA (0.55) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL6907008 0.78 TTR (0.50) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL7164712 0.77 MAOA (0.47) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL27779562 0.76 MAOA (0.55) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL769934 0.76 MAOA (0.71) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL27485054 0.75 MAOA (0.36) MAOACA1CA2CA7CA9
SCHEMBL3741443 0.74 KCNA3 (0.50) MAOACES1BCHEALDH1A1KDM4E
SCHEMBL15395531 0.74 PNMT (0.45) CA1CA2CA7CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6720344-B2 BINDING TO NUCLEAR RECEPTOR PROTEINS; STIMULATING BMP-2 PROMOTER ACTIVITY THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2004-04-13 US disclosed
US-20030119791-A1 Methods and compositions for stimulating osteoblast proliferation or treating malignant cell proliferation and methods for selecting osteoblast proliferation stimulants KERWIN SEAN M (US) 2003-06-26 US disclosed
EP-0912549-A4 COMPOUNDS AND METHODS FOR PROVIDING PHARMACOLOGICALLY ACTIVE PREPARATIONS AND USES THEREOF UNIV TEXAS (US) 2002-01-02 EP disclosed
CN-1226245-A Compound with pharmacological activity, preparation method and application thereof UNIV TEXAS (US) 1999-08-18 CN disclosed
EP-0912549-A1 COMPOUNDS AND METHODS FOR PROVIDING PHARMACOLOGICALLY ACTIVE PREPARATIONS AND USES THEREOF THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-05-06 EP disclosed
WO-1997048694-A1 COMPOUNDS AND METHODS FOR PROVIDING PHARMACOLOGICALLY ACTIVE PREPARATIONS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1997-12-24 WO 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-20030119791-A1 Methods and compositions for stimulating osteoblast proliferation or treating malignant cell proliferation and methods for selecting osteoblast proliferation stimulants MKI67, HGF, AREG MAOA 2002/4885CA1 2296/4885CA2 1176/4885

“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.