SCHEMBL16319117

SCHEMBL16319117

COc1ccc(F)c(-c2ncc(CBr)cc2CC2(C#N)CCCC2)c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
FFAR1 O14842 15/20 0.35
KDM1A O60341 1/20 0.33
PIM1 P11309 1/20 0.33
P2RX7 Q99572 1/20 0.32

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
SCHEMBL16319322 0.90 FFAR1 (0.36) CNR1CNR2FFAR1KDM1A
SCHEMBL16318884 0.85 FFAR1 (0.35) FFAR1
SCHEMBL16318579 0.76 FFAR1 (0.39) CNR1CNR2FFAR1KDM1APIM1
SCHEMBL16318924 0.75 FFAR1 (0.52) FFAR1
SCHEMBL16318844 0.74 FFAR1 (0.42) FFAR1
SCHEMBL16319250 0.74 FFAR1 (0.36) FFAR1
SCHEMBL16319329 0.73 FFAR1 (0.44) FFAR1
SCHEMBL16318652 0.73 SMN1; SMN2 (0.32) FFAR1
SCHEMBL16318804 0.73 FFAR1 (0.35) FFAR1
SCHEMBL16319294 0.72 FFAR1 (0.36) FFAR1

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-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 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 (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-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 CNR1 216/4885CNR2 336/4885FFAR1 31/4885

“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.