SCHEMBL16410308

SCHEMBL16410308

CCc1sc(-c2cc(F)cc(CNC(=O)OC(C)(C)C)c2)nc1C(=O)Nc1ccccc1CC(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HDAC1 Q13547 2/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.36
▸ SUCNR1 Q9BXA5 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ GLS O94925 4/20 0.35
▸ GRM2 Q14416 1/20 0.34
▸ CFD P00746 1/20 0.34
▸ TP53 P04637 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
SCHEMBL17764353 0.94 SUCNR1 (0.41) LMNAL3MBTL1HDAC1DYRK1AKDM4E
SCHEMBL16409647 0.91 HDAC1 (0.38) LMNAHDAC1DYRK1AKDM4ESUCNR1
SCHEMBL16410431 0.89 HDAC1 (0.37) LMNAHDAC1DYRK1ASUCNR1MAPT
SCHEMBL16410346 0.88 HDAC1 (0.36) LMNAL3MBTL1HDAC1DYRK1AKDM4E
SCHEMBL16410326 0.87 HDAC1 (0.36) LMNAHDAC1DYRK1ASUCNR1MAPT
SCHEMBL17764428 0.85 SUCNR1 (0.44) LMNAHDAC1DYRK1AKDM4ESUCNR1
SCHEMBL17764316 0.83 SUCNR1 (0.41) LMNAHDAC1DYRK1ASUCNR1GLS
SCHEMBL17764474 0.82 SUCNR1 (0.40) LMNAHDAC1DYRK1ASUCNR1GLS
SCHEMBL16410323 0.82 DYRK1A (0.37) LMNAL3MBTL1HDAC1DYRK1AMAPT
SCHEMBL17764311 0.81 SUCNR1 (0.41) LMNAHDAC1DYRK1ASUCNR1GLS

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-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
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 LMNA 1205/4885L3MBTL1 4764/4885HDAC1 3377/4885

“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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