SCHEMBL4336479

SCHEMBL4336479

C[C@H](N)c1cc(F)nc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.36
PDE2A O00408 2/20 0.33
AAK1 Q2M2I8 1/20 0.33
PARP14 Q460N5 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
SCHEMBL4734693 0.79 GABRA1 (0.34)
SCHEMBL17028403 0.75 ADRB2 (0.36) ADRB2PDE2A
SCHEMBL28297439 0.75 ADRB2 (0.36) ADRB2PDE2A
SCHEMBL8638829 0.74 ADRB2 (0.48) ADRB2PDE2A
SCHEMBL24008886 0.74 ADRB2 (0.48) ADRB2PDE2A
SCHEMBL557913 0.74 IDO1 (0.42) ADRB2PDE2A
SCHEMBL1728961 0.74 IDO1 (0.42) ADRB2PDE2A
SCHEMBL1004099 0.74 IDO1 (0.42) ADRB2PDE2A
SCHEMBL22624077 0.73
SCHEMBL20771993 0.73 LOXL2 (0.44) ADRB2PDE2AAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618960-B2 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-17 US disclosed
EP-1953154-A1 MORPHOLINE TYPE CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117798-A1 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 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-20070117798-A1 Morpholine type cinnamide compound MLX, XDH, NOX4 ADRB2 95/4885PDE2A 992/4885AAK1 2644/4885

“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.