SCHEMBL16397190

SCHEMBL16397190

NCc1cc(F)cc(-c2cccc(C(=O)Nc3c(Br)cccc3CC(=O)O)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 12/20 0.58
▸ CTSA P10619 1/20 0.41
▸ F11 P03951 2/20 0.39
▸ TPSB2 P20231 2/20 0.39
▸ SUCNR1 Q9BXA5 1/20 0.39
▸ PTGDR2 Q9Y5Y4 1/20 0.38
▸ CNR2 P34972 2/20 0.36
▸ PLAU P00749 2/20 0.36
▸ MAP4K4 O95819 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PLG P00747 1/20 0.35
▸ KLKB1 P03952 1/20 0.35
▸ F7 P08709 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34

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
SCHEMBL16397300 0.90 CFD (0.59) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16397161 0.86 CFD (0.78) CFDCTSAF11TPSB2SUCNR1
SCHEMBL28069940 0.83 CFD (0.68) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16396602 0.81 CFD (0.63) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16396871 0.81 CFD (0.62) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16397683 0.80 CFD (0.61) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16397441 0.80 CFD (0.61) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16397262 0.79 CFD (0.59) CFDCTSAF11TPSB2SUCNR1
SCHEMBL16396922 0.73 CFD (1.00) CFDF11TPSB2SUCNR1CNR2
SCHEMBL16410330 0.72 CFD (0.60) CFDF11TPSB2SUCNR1PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145247-A1 Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof NOVARTIS AG (CH) 2016-05-26 — — US disclosed
US-20160145247-A1 Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof NOVARTIS AG (CH) 2016-05-26 — — US disclosed
US-20160145247-A1 Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof NOVARTIS AG (CH) 2016-05-26 — — US disclosed
EP-3022182-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF Novartis AG (CH) 2016-05-25 — — EP disclosed
CN-105555766-A Aminomethyl-biaryl derivatives as complement factor D inhibitors and uses thereof NOVARTIS AG 2016-05-04 — — CN disclosed
WO-2015009977-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2015-01-22 — — WO 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-20160145247-A1 Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof CFD, CFH, CFB CFD 1/4885CTSA 1277/4885F11 17/4885

“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.

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