SCHEMBL16410316

SCHEMBL16410316

C[C@@H](NC(=O)OC(C)(C)C)c1cccc(-c2cc(COc3ccccc3CC(=O)OC(C)(C)C)cc(NC[C@@H]3CCCO3)c2)c1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HPGD P15428 3/20 0.36
▸ CFD P00746 2/20 0.36
▸ CYP1A2 P05177 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ F11 P03951 1/20 0.34
▸ TPSB2 P20231 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CCR5 P51681 1/20 0.33
▸ CACNA1B Q00975 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL16410314 1.00 L3MBTL1 (0.36) L3MBTL1HPGDCFDCYP1A2MAPT
SCHEMBL17764529 0.95 CFD (0.41) L3MBTL1HPGDCFDCYP1A2MAPT
SCHEMBL17764515 0.95 CFD (0.41) L3MBTL1HPGDCFDCYP1A2MAPT
SCHEMBL17764513 0.95 CFD (0.41) L3MBTL1HPGDCFDCYP1A2MAPT
SCHEMBL16410454 0.90 CFD (0.36) L3MBTL1HPGDCFDCYP1A2MAPT
SCHEMBL16410261 0.90 CFD (0.38) CFDF11TPSB2KMT2ACACNA1B
SCHEMBL16410420 0.90 CFD (0.38) CFDF11TPSB2KMT2ACACNA1B
SCHEMBL16397222 0.90 CFD (0.38) CFDCYP1A2F11TPSB2MEN1
SCHEMBL16410408 0.90 CFD (0.38) CFDCYP1A2F11TPSB2MEN1
SCHEMBL17764394 0.89 CFD (0.37) L3MBTL1HPGDCFDMAPTGAA

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 2 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
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 L3MBTL1 4764/4885HPGD 1155/4885CFD 1/4885

“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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