SCHEMBL2322993

SCHEMBL2322993

Cc1ccccc1N[C@@H](CS)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
HPGD P15428 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.45
ITGB3 P05106 2/20 0.44
ITGAV P06756 2/20 0.44
ITGB1 P05556 1/20 0.44
ITGA5 P08648 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX12 P18054 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL9638522 1.00 RAB9A (0.46) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL27873589 0.87 MAPT (0.49) ALDH1A1MAPTPOLBLMNAPKM
SCHEMBL2331792 0.87 RAB9A (0.43) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL27974448 0.87 RAB9A (0.43) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL7561830 0.85 RAB9A (0.47) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL679864 0.85 RAB9A (0.47) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL2327480 0.84 SMN1; SMN2 (0.44) RAB9ANPC1HPGDALDH1A1HTT
SCHEMBL8435071 0.83 PYGL (0.53) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL28130587 0.83 RAB9A (0.46) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL16340022 0.83 PYGL (0.53) RAB9ANPC1HPGDALDH1A1MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356979-B1 ANTI-WRINKLE AGENTS POLA CHEM IND INC (JP) 2017-10-25 EP disclosed
EP-3173063-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2017-05-31 EP disclosed
US-8835498-B2 Anti-wrinkle agents POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-16 US disclosed
US-20110245343-A1 ANTI-WRINKLE AGENTS POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 US disclosed
EP-2356979-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2011-08-17 EP 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-20110245343-A1 ANTI-WRINKLE AGENTS GLA, H1-4, H1-3 RAB9A 4160/4885NPC1 4142/4885HPGD 1394/4885

“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.