SCHEMBL16844693

SCHEMBL16844693

O=C(O)CCc1cccc(OC2CCc3ccc(-c4ccccc4)cc32)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GFRA3 O60609 7/20 0.52
RET P07949 3/20 0.52
FFAR4 Q5NUL3 4/20 0.46
FFAR1 O14842 8/20 0.46
AKR1B1 P15121 1/20 0.46
GFRA2 O00451 4/20 0.45
LIPG Q9Y5X9 1/20 0.43
GFRA1 P56159 2/20 0.42
PTGER4 P35408 1/20 0.41
PTGER3 P43115 1/20 0.41

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
SCHEMBL16841443 0.93 GFRA3 (0.49) GFRA3RETFFAR4FFAR1GFRA2
SCHEMBL1745543 0.89 FFAR1 (0.51) GFRA3RETFFAR4FFAR1AKR1B1
SCHEMBL1744798 0.83 FFAR1 (0.53) GFRA3RETFFAR4FFAR1AKR1B1
SCHEMBL1745124 0.81 GFRA3 (0.52) GFRA3RETFFAR4FFAR1GFRA2
SCHEMBL1632826 0.78 FFAR1 (0.64) FFAR4FFAR1AKR1B1
SCHEMBL15679163 0.78 FFAR1 (0.36) GFRA3RETFFAR4FFAR1AKR1B1
SCHEMBL1745473 0.77 FFAR1 (0.48) GFRA3RETFFAR4FFAR1AKR1B1
SCHEMBL1744587 0.77 RXRA (0.58) FFAR4FFAR1AKR1B1
SCHEMBL1744979 0.77 FFAR1 (0.54) GFRA3RETFFAR4FFAR1AKR1B1
SCHEMBL14567251 0.76 FFAR1 (0.50) GFRA3RETFFAR4FFAR1AKR1B1

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-9388153-B2 Secondary amines as therapeutic agents ALLERGAN, INC. (US) 2016-07-12 US disclosed
WO-2015094864-A1 SECONDARY AMINES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2015-06-25 WO disclosed
US-20150175567-A1 SECONDARY AMINES AS THERAPEUTIC AGENTS ALLERGAN, INC. 2015-06-25 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-20150175567-A1 SECONDARY AMINES AS THERAPEUTIC AGENTS PDE6G, PDE3A, TYR GFRA3 1030/4885RET 1511/4885FFAR4 4457/4885

“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.