SCHEMBL16397193

SCHEMBL16397193

COCCOc1cc(C(=O)Nc2ccccc2CC(=O)O)cc(-c2cc(F)cc(CNC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SUCNR1 Q9BXA5 12/20 0.47
▸ HDAC1 Q13547 2/20 0.46
▸ NR1H4 Q96RI1 1/20 0.41
▸ CFD P00746 4/20 0.41
▸ F11 P03951 1/20 0.41
▸ TPSB2 P20231 1/20 0.41
▸ HTT P42858 1/20 0.36

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
SCHEMBL16397314 0.87 SUCNR1 (0.49) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL16396992 0.87 SUCNR1 (0.60) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL17764462 0.86 SUCNR1 (0.48) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL16403609 0.85 SUCNR1 (0.56) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL17764302 0.85 SUCNR1 (0.43) SUCNR1HDAC1
SCHEMBL16396204 0.83 SUCNR1 (0.46) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL16396862 0.81 SUCNR1 (0.49) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL21455909 0.81 SUCNR1 (0.46) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL16396451 0.81 HDAC1 (0.44) SUCNR1HDAC1NR1H4CFDF11
SCHEMBL16410368 0.80 HDAC1 (0.44) SUCNR1HDAC1NR1H4CFDF11

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 5 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
EP-3022182-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF Novartis AG (CH) 2016-05-25 — — EP disclosed
WO-2015009977-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2015-01-22 — — WO 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 SUCNR1 4670/4885HDAC1 3377/4885NR1H4 901/4885

“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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