SCHEMBL1746574

SCHEMBL1746574

OC1CCc2ccc(OCc3ccccc3)cc21

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.53
CYP2D6 P10635 3/20 0.51
HRH1 P35367 1/20 0.51
GRIN1 Q05586 4/20 0.50
GRIN2B Q13224 4/20 0.50
MAOA P21397 3/20 0.49
MAOB P27338 3/20 0.49
KDM1A O60341 2/20 0.49
CA2 P00918 1/20 0.49
CA5A P35218 1/20 0.49
ALOX5 P09917 1/20 0.47

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
SCHEMBL1746466 0.89 GRIN1 (0.61) HRH3CYP2D6HRH1GRIN1GRIN2B
SCHEMBL3965085 0.89 GRIN1 (0.61) HRH3CYP2D6HRH1GRIN1GRIN2B
SCHEMBL3970687 0.89 GRIN1 (0.61) HRH3CYP2D6HRH1GRIN1GRIN2B
SCHEMBL21126509 0.81 GRIN1 (0.58) GRIN1GRIN2BCA2CA5A
SCHEMBL17583857 0.80 CA2 (0.46) HRH3CYP2D6HRH1GRIN1GRIN2B
SCHEMBL18983590 0.79 HRH3 (0.59) HRH3CYP2D6HRH1
SCHEMBL7177129 0.79 CSF1R (0.42) HRH3CYP2D6MAOAMAOB
SCHEMBL7175987 0.79 CSF1R (0.42) HRH3CYP2D6MAOAMAOB
SCHEMBL7176955 0.79 CSF1R (0.42) HRH3CYP2D6MAOAMAOB
SCHEMBL3750778 0.78 FFAR1 (0.53) HRH3MAOAMAOBKDM1A

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10576087-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2020-03-03 US disclosed
US-10576087-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2020-03-03 US disclosed
US-20190000857-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2019-01-03 US disclosed
US-20190000857-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2019-01-03 US disclosed
EP-3124472-B1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEIGENE LTD (KY) 2018-07-25 EP disclosed
US-9895376-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2018-02-20 US disclosed
US-9895376-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2018-02-20 US disclosed
US-9895376-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2018-02-20 US disclosed
EP-3124472-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BeiGene, Ltd. (KY) 2017-02-01 EP disclosed
EP-3124472-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BeiGene, Ltd. (KY) 2017-02-01 EP disclosed
US-20150045355-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2015-02-12 US disclosed
US-20150045355-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2015-02-12 US disclosed
EP-2797888-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BeiGene, Ltd. (KY) 2014-11-05 EP disclosed
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
WO-2013097224-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEIGENE, LTD. (KY) 2013-07-04 WO disclosed
WO-2013097224-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEIGENE, LTD. (KY) 2013-07-04 WO disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 EP 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 (4 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR HRH3 596/4885CYP2D6 4239/4885HRH1 482/4885
US-20150045355-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF HRH3 3151/4885CYP2D6 3301/4885HRH1 2939/4885
US-20190000857-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF HRH3 3165/4885CYP2D6 3560/4885HRH1 3015/4885
US-10576087-B2 Fused tricyclic compounds as Raf kinase inhibitors BRAF, RAF1, ARAF HRH3 3151/4885CYP2D6 3301/4885HRH1 2939/4885

“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.