SCHEMBL3662835

SCHEMBL3662835

O=C(N[C@@H](Cc1cccc2ccccc12)C(=O)O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.60
HRH4 Q9H3N8 1/20 0.60
ACE P12821 4/20 0.58
MME P08473 2/20 0.58
CPA1 P15085 1/20 0.58
ACE2 Q9BYF1 1/20 0.58
CCKBR P32239 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
MMP9 P14780 2/20 0.51
UBASH3B Q8TF42 1/20 0.51
PTPN1 P18031 2/20 0.50
ITGB2 P05107 2/20 0.50
ICAM1 P05362 2/20 0.50
ITGAL P20701 2/20 0.50
MMP8 P22894 1/20 0.50
MMP14 P50281 1/20 0.50
ERAP2 Q6P179 1/20 0.49
NPC1 O15118 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL9461912 1.00 CTNNB1 (0.60) CTNNB1HRH4ACEMMECPA1
SCHEMBL8674187 1.00 CTNNB1 (0.60) CTNNB1HRH4ACEMMECPA1
SCHEMBL3653685 0.93 HRH4 (0.56) CTNNB1HRH4ACEMMECPA1
SCHEMBL3660787 0.92 HRH4 (0.55) CTNNB1HRH4ACEMMECPA1
SCHEMBL4704798 0.91 HRH4 (0.54) CTNNB1HRH4ACEMMECPA1
SCHEMBL3659456 0.91 MME (0.56) CTNNB1HRH4ACEMMECPA1
SCHEMBL3662415 0.91 HRH4 (0.54) CTNNB1HRH4ACEMMECPA1
SCHEMBL3656657 0.91 HRH4 (0.54) CTNNB1HRH4ACEMMECPA1
SCHEMBL3658919 0.88 MME (0.54) CTNNB1HRH4ACEMMECPA1
SCHEMBL3661746 0.88 PIN1 (0.62) CTNNB1HRH4ACEMMECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364424-B2 Topical cosmetic skin lightening compositions and methods of use thereof STIEFEL LABORATORIES, INC. (US) 2016-06-14 US disclosed
US-20160074315-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. 2016-03-17 US disclosed
EP-2219600-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. (US) 2010-08-25 EP disclosed
WO-2009067095-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. (US) 2009-05-28 WO disclosed
EP-1602354-B1 Use of polyglutamic acid or its salts MEIJI SEIKA KAISHA (JP) 2008-11-05 EP disclosed
EP-1604647-B1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof CHISSO CORP (JP) 2008-05-07 EP disclosed
US-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair MEIJI SEIKA KAISHA, LTD. (JP) 2006-07-27 US disclosed
US-20060018867-A1 Cosmetic composition and production thereof ICHIMARU PHARCOS CO., LTD 2006-01-26 US disclosed
EP-1604647-A1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof Ichimaru Pharcos Co., Ltd. (JP) 2005-12-14 EP disclosed
EP-1602354-A1 HAIR TREATMENT COMPOSITION AND HAIR COSMETIC FOR DAMAGED HAIR Meiji Seika Kaisha, Ltd. (JP) 2005-12-07 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 (2 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-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair CUTA, COL14A1, PRKDC CTNNB1 4720/4885HRH4 2183/4885ACE 4366/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR CTNNB1 4820/4885HRH4 1664/4885ACE 3194/4885

“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.