SCHEMBL6367407

SCHEMBL6367407

COCc1cccc(-c2cc(F)cc3c2OC(C)C3)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
PARP1 P09874 6/20 0.41
AQP1 P29972 3/20 0.39
KCNH2 Q12809 1/20 0.35
AGXT P21549 1/20 0.34
GYS1 P13807 1/20 0.34
MTOR P42345 1/20 0.32
DHODH Q02127 1/20 0.32
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
PRKAB1 Q9Y478 1/20 0.32
HTR7 P34969 1/20 0.32
ERN1 O75460 1/20 0.32

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
SCHEMBL4597647 0.82 PARP1 (0.48) BRD4CREBBPPARP1AQP1HTR7
SCHEMBL4710706 0.82 PARP1 (0.43) PARP1AQP1HTR7
SCHEMBL5060191 0.80 PARP1 (0.46) BRD4PARP1AQP1
SCHEMBL4596637 0.76 PARP1 (0.51) BRD4PARP1AQP1
SCHEMBL4595377 0.75 PARP1 (0.46) PARP1AQP1
SCHEMBL4597059 0.73 PARP1 (0.47) PARP1AQP1
SCHEMBL4596742 0.73 PARP1 (0.49) BRD4PARP1AQP1
SCHEMBL4712667 0.73 AQP1 (0.49) BRD4CREBBPPARP1AQP1PRKAB2
SCHEMBL4595445 0.72 PARP1 (0.51) BRD4CREBBPPARP1AQP1PRKAB2
SCHEMBL4963750 0.72 PARP1 (0.48) BRD4PARP1AQP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261347-A1 Dihydrobenzofuranyl alkanamine derivatives and methods for using same WYETH (US) 2005-11-24 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-20050261347-A1 Dihydrobenzofuranyl alkanamine derivatives and methods for using same ADRA2A, HTR2A, ADRA1A L3MBTL1 2338/4885BRD4 1979/4885CREBBP 2627/4885

“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.