SCHEMBL43741

SCHEMBL43741

CCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.64
HDAC6 Q9UBN7 7/20 0.64
GRIA1 P42261 1/20 0.58
MDM4 O15151 1/20 0.58
MDM2 Q00987 1/20 0.58
ALDH1A1 P00352 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
LNPEP Q9UIQ6 1/20 0.55

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
SCHEMBL42986 1.00 HDAC1 (0.64) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL27910970 0.99 HDAC1 (0.66) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL14472130 0.99 HDAC1 (0.66) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL2337076 0.99 HDAC1 (0.66) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL18220518 0.99 HDAC1 (0.66) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL14472192 0.99 HDAC1 (0.66) HDAC1HDAC6GRIA1MDM4MDM2
SCHEMBL26114055 0.92 CNR1 (0.67) HDAC1HDAC6GRIA1CNR1CNR2
SCHEMBL31370880 0.92 CNR1 (0.67) HDAC1HDAC6GRIA1CNR1CNR2
SCHEMBL15132624 0.90 HDAC1 (0.64) HDAC1HDAC6
SCHEMBL6650599 0.89 ITGB3 (0.58) HDAC1HDAC6GRIA1CNR1

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-20240082131-A1 COMPOSITION FOR IMPROVING SKIN CONDITIONS NEOPHARM CO., LTD. (KR) 2024-03-14 US disclosed
US-20220142888-A1 COMPOSITION FOR IMPROVING SKIN CONDITIONS NEOPHARM CO., LTD. (KR) 2022-05-12 US disclosed
US-20220142888-A1 COMPOSITION FOR IMPROVING SKIN CONDITIONS NEOPHARM CO., LTD. (KR) 2022-05-12 US disclosed
US-8809390-B2 Compound accelerating secretion of human-derived anti-microbial peptide, method for preparing same, and composition having same as active ingredient NEOPHARM CO., LTD. (KR) 2014-08-19 US disclosed
US-8809390-B2 Compound accelerating secretion of human-derived anti-microbial peptide, method for preparing same, and composition having same as active ingredient NEOPHARM CO., LTD. (KR) 2014-08-19 US disclosed
US-20130190397-A1 NOVEL COMPOUND ACCELERATING SECRETION OF HUMAN-DERIVED ANTI-MICROBIAL PEPTIDE, METHOD FOR PREPARING SAME, AND COMPOSITION HAVING SAME AS ACTIVE INGREDIENT NEOPHARM CO., LTD. (KR) 2013-07-25 US disclosed
US-20130190397-A1 NOVEL COMPOUND ACCELERATING SECRETION OF HUMAN-DERIVED ANTI-MICROBIAL PEPTIDE, METHOD FOR PREPARING SAME, AND COMPOSITION HAVING SAME AS ACTIVE INGREDIENT NEOPHARM CO., LTD. (KR) 2013-07-25 US disclosed
EP-2617707-A1 NOVEL COMPOUND ACCELERATING SECRETION OF HUMAN-DERIVED ANTI-MICROBIAL PEPTIDE, METHOD FOR PREPARING SAME, AND COMPOSITION HAVING SAME AS ACTIVE INGREDIENT Neopharm Co., Ltd. (KR) 2013-07-24 EP disclosed
WO-2012026639-A1 NOVEL COMPOUND ACCELERATING SECRETION OF HUMAN-DERIVED ANTI-MICROBIAL PEPTIDE, METHOD FOR PREPARING SAME, AND COMPOSITION HAVING SAME AS ACTIVE INGREDIENT (주)네오팜 (KR) 2012-03-01 WO disclosed
CN-102167766-A Vinyl amino acid (ester) polymer and preparation method thereof UNIV BEIJING CHEMICAL 2011-08-31 CN 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 (3 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-20130190397-A1 NOVEL COMPOUND ACCELERATING SECRETION OF HUMAN-DERIVED ANTI-MICROBIAL PEPTIDE, METHOD FOR PREPARING SAME, AND COMPOSITION HAVING SAME AS ACTIVE INGREDIENT VIP, MRPL37, DBNL HDAC1 4491/4885HDAC6 3907/4885GRIA1 3808/4885
US-20240082131-A1 COMPOSITION FOR IMPROVING SKIN CONDITIONS CUTA, DSG1, IGFBP5 HDAC1 1559/4885HDAC6 2233/4885GRIA1 4470/4885
US-20220142888-A1 COMPOSITION FOR IMPROVING SKIN CONDITIONS CUTA, DSG1, IGFBP5 HDAC1 1559/4885HDAC6 2233/4885GRIA1 4470/4885

“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.