SCHEMBL10360964

SCHEMBL10360964

O=C1Cc2ccc(F)cc2OC1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.49
CYP19A1 P11511 3/20 0.42
NR3C2 P08235 1/20 0.38
AKR1B1 P15121 1/20 0.38
PARP1 P09874 2/20 0.35
CA2 P00918 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL10360821 0.88 MAOB (0.49) MAOBCYP19A1NR3C2AKR1B1PARP1
SCHEMBL130268 0.82 CYP19A1 (0.49) MAOBCYP19A1ALDH1A1
SCHEMBL6703209 0.82 CYP19A1 (0.42) CYP19A1CA2ALDH1A1
SCHEMBL13730471 0.82 CYP19A1 (0.49) MAOBCYP19A1ALDH1A1
SCHEMBL2474551 0.82 MAOB (0.49) MAOBCYP19A1
SCHEMBL10426192 0.81 CYP19A1 (0.46) MAOBCYP19A1NR3C2ALDH1A1
SCHEMBL19746 0.81 CYP19A1 (0.45) MAOBCYP19A1CA2ALDH1A1
SCHEMBL11733122 0.80 CYP19A1 (0.44) MAOBCYP19A1CA2ALDH1A1
Methane SCHEMBL27973705 0.80 CYP19A1 (0.44) MAOBCYP19A1CA2ALDH1A1
SCHEMBL131516 0.79 CYP19A1 (0.52) MAOBCYP19A1ALDH1A1

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
EP-0139614-B1 PHARMACEUTICAL PREPARATIONS CONTAINING FLAVANONE OR THIOFLAVANONE DERIVATIVES, THE USE THEREOF, NOVEL FLAVANONES AND THIOFLAVANONES, AND PROCESSES FOR THEIR MANUFACTURE Zyma SA (CH) 1990-08-22 EP disclosed
US-4935441-A Flavene and thioflavene derivates, processes for their manufacture, pharmaceutical preparations that contain such compounds, and the use of the latter ZYMA SA (CH) 1990-06-19 US disclosed
US-4885298-A Pharmaceutical preparations containing flavanone or thioflavanone derivatives the use thereof, novel flavanones and thioflavanones, and processes for their manufacture ZYMA SA (CH) 1989-12-05 US disclosed
EP-0139615-B1 FLAVENE AND THIOFLAVENE DERIVATIVES, PROCESSES FOR THEIR MANUFACTURE, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SUCH COMPOUNDS, AND THE USE OF THE LATTER Zyma SA (CH) 1989-04-19 EP disclosed
EP-0139615-A2 Flavene and thioflavene derivatives, processes for their manufacture, pharmaceutical preparations that contain such compounds, and the use of the latter Zyma SA (CH) 1985-05-02 EP disclosed
EP-0139614-A2 Pharmaceutical preparations containing flavanone or thioflavanone derivatives, the use thereof, novel flavanones and thioflavanones, and processes for their manufacture Zyma SA (CH) 1985-05-02 EP disclosed