SCHEMBL3662472

SCHEMBL3662472

CCCC(CCC)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.67
MME P08473 2/20 0.65
ACE P12821 2/20 0.65
CPA1 P15085 1/20 0.65
ACE2 Q9BYF1 1/20 0.65
HDAC3 O15379 2/20 0.54
HDAC4 P56524 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
MMP9 P14780 3/20 0.53
MMP8 P22894 2/20 0.53
MMP2 P08253 1/20 0.53
MMP14 P50281 1/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47

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
SCHEMBL3658077 0.89 ACE (0.67) HRH4MMEACECPA1ACE2
SCHEMBL4653549 0.88 MME (0.67) HRH4MMEACECPA1ACE2
SCHEMBL3659047 0.85 ACE (0.73) HRH4MMEACECPA1ACE2
SCHEMBL8672215 0.85 ACE (0.73) HRH4MMEACECPA1ACE2
SCHEMBL3659333 0.84 ACE (0.68) HRH4MMEACECPA1ACE2
SCHEMBL7290280 0.83 MME (0.64) HRH4MMEACECPA1ACE2
SCHEMBL10867308 0.83 HRH4 (0.56) HRH4MMEACECPA1ACE2
SCHEMBL10867305 0.83 HRH4 (0.56) HRH4MMEACECPA1ACE2
SCHEMBL3660841 0.83 MME (0.62) HRH4MMEACECPA1ACE2
SCHEMBL8668240 0.83 MME (0.62) HRH4MMEACECPA1ACE2

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 HRH4 2183/4885MME 3331/4885ACE 4366/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR HRH4 1664/4885MME 570/4885ACE 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.