SCHEMBL7976156

SCHEMBL7976156

COc1c(F)c(OC)c(C#N)c(OC)c1F

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
SQOR Q9Y6N5 6/20 0.33
ADORA1 P30542 3/20 0.32
ADORA2A P29274 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
RECQL P46063 1/20 0.31
TRPV4 Q9HBA0 1/20 0.30

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
SCHEMBL7960238 0.91 LMNA (0.32) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL10380920 0.87 LMNA (0.34) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL10721123 0.85 HSD17B10 (0.32) RECQLTRPV4
SCHEMBL7870115 0.83 HSD17B10 (0.32)
SCHEMBL10619225 0.81 LMNA (0.32) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL5930636 0.78 RECQL (0.34) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL186103 0.75 SLC6A3 (0.36) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL29518830 0.75 SLC6A3 (0.36) LMNAMAPTCYP2C9SQORADORA1
SCHEMBL14314915 0.74 KDM4E (0.33) LMNAMAPTCYP2C9SQORKDM4E
SCHEMBL15647959 0.74 MAPK8 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6229055-B1 SYNTHESIS OF FLUORINATED RESORCINOL WHICH IS USEFUL IN THE PREPARATION OF FLUORINATED FLUORESCEIN AND RHODOL DYES SUITABLE FOR USE AS TRACERS, LABELS, OR INTERMEDIATES MOLECULAR PROBES, INC. 2001-05-08 US disclosed
US-6162931-A Fluorinated xanthene derivatives MOLECULAR PROBES, INC. (US) 2000-12-19 US disclosed