SCHEMBL17764474

SCHEMBL17764474

C=Cc1sc(-c2cc(F)cc(CNC(=O)OC(C)(C)C)c2)nc1C(=O)Nc1ccccc1CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SUCNR1 Q9BXA5 4/20 0.40
▸ HDAC1 Q13547 2/20 0.40
▸ DYRK1A Q13627 1/20 0.36
▸ GLS O94925 7/20 0.36
▸ NR1H4 Q96RI1 1/20 0.35
▸ CFD P00746 4/20 0.35
▸ F11 P03951 1/20 0.34
▸ TPSB2 P20231 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GRM2 Q14416 1/20 0.33

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
SCHEMBL16410346 0.94 HDAC1 (0.36) SUCNR1HDAC1DYRK1AGLSCFD
SCHEMBL17764428 0.89 SUCNR1 (0.44) SUCNR1HDAC1DYRK1AGLSNR1H4
SCHEMBL17764316 0.88 SUCNR1 (0.41) SUCNR1HDAC1DYRK1AGLSNR1H4
SCHEMBL17764353 0.88 SUCNR1 (0.41) SUCNR1HDAC1DYRK1AGLSNR1H4
SCHEMBL17764311 0.86 SUCNR1 (0.41) SUCNR1HDAC1DYRK1AGLSNR1H4
SCHEMBL16409647 0.83 HDAC1 (0.38) SUCNR1HDAC1DYRK1AGLSCFD
SCHEMBL16410431 0.82 HDAC1 (0.37) SUCNR1HDAC1DYRK1AGLSCFD
SCHEMBL16410308 0.82 LMNA (0.41) SUCNR1HDAC1DYRK1AGLSCFD
SCHEMBL17764271 0.81 HDAC1 (0.37) SUCNR1HDAC1DYRK1AGLSGRM2
SCHEMBL16410326 0.80 HDAC1 (0.36) SUCNR1HDAC1DYRK1AGLSLMNA

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 1 patent. 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

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 3377/4885DYRK1A 3832/4885

“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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