SCHEMBL4207996

SCHEMBL4207996

CCCC[C@@H](C)C[C@@H](CC(=O)OCC)N(Cc1ccccc1)C(C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
F2 P00734 1/20 0.39
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.37
FAAH O00519 1/20 0.37
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
ALOX5 P09917 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.34
CNR2 P34972 1/20 0.34
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4208000 1.00 F10 (0.39) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL4192216 0.94 ALDH1A1 (0.40) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL5188655 0.94 ALDH1A1 (0.40) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL4192209 0.94 ALDH1A1 (0.40) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL4196745 0.90 ALDH1A1 (0.41) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL4196740 0.90 ALDH1A1 (0.41) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL4205630 0.88 POLB (0.40) POLBCTSLCTSSCTSKKMT2A
SCHEMBL4205633 0.88 POLB (0.40) POLBCTSLCTSSCTSKKMT2A
SCHEMBL7572356 0.88 ALDH1A1 (0.42) F10ALDH1A1POLBLMNAHSD17B10
SCHEMBL2311421 0.87 ALDH1A1 (0.43) F10ALDH1A1POLBLMNAHSD17B10

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-20090247743-A1 PREPARATION OF BETA-AMINO ACIDS HAVING AFFINITY FOR THE ALPHA-2-DELTA PROTEIN PFIZER INC 2009-10-01 US claimed
US-20090247743-A1 PREPARATION OF BETA-AMINO ACIDS HAVING AFFINITY FOR THE ALPHA-2-DELTA PROTEIN PFIZER INC 2009-10-01 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-20090247743-A1 PREPARATION OF BETA-AMINO ACIDS HAVING AFFINITY FOR THE ALPHA-2-DELTA PROTEIN SCN2A, SCN1A, ORAI2 F10 1770/4885ALDH1A1 1839/4885POLB 2428/4885

“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.