SCHEMBL16680294

SCHEMBL16680294

COC(=O)CC(NC(=O)OC(C)(C)C)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
CTSS P25774 3/20 0.46
CTSK P43235 3/20 0.46
FAAH O00519 1/20 0.43
LMNA P02545 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.42
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
AGTR1 P30556 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2D6 P10635 1/20 0.39
SCN9A Q15858 3/20 0.38

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
SCHEMBL16680292 1.00 HTT (0.48) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL27609243 0.88 CTSS (0.49) CTSSCTSKFAAHLMNAMEN1
SCHEMBL3339675 0.88 CTSS (0.49) CTSSCTSKFAAHLMNAMEN1
SCHEMBL1147851 0.88 CTSS (0.49) CTSSCTSKFAAHLMNAMEN1
SCHEMBL24440386 0.88 PPARG (0.43) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL24440108 0.88 MEN1 (0.41) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL5221967 0.88 MEN1 (0.41) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL7334591 0.88 CTSS (0.44) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL13118106 0.88 CTSS (0.44) HTTALDH1A1MAPTCTSSCTSK
SCHEMBL16680702 0.88 MEN1 (0.41) HTTALDH1A1MAPTCTSSCTSK

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-9452990-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-09-27 US disclosed
US-20150126492-A1 Complement Pathway Modulators and Uses Thereof NOVARTIS AG (CH) 2015-05-07 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-20150126492-A1 Complement Pathway Modulators and Uses Thereof CFB, CFH, TFPI HTT 3718/4885ALDH1A1 2221/4885MAPT 3161/4885

“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.