SCHEMBL19483349

SCHEMBL19483349

CC(C)CC(Cc1ccccc1)C(=O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.55
▸ RNPEP Q9H4A4 1/20 0.55
▸ DNPEP Q9ULA0 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ MME P08473 1/20 0.51
▸ ACE P12821 1/20 0.49
▸ CPA1 P15085 2/20 0.49
▸ CPA3 P15088 2/20 0.49
▸ SLC1A3 P43003 1/20 0.49
▸ SLC1A2 P43004 1/20 0.49
▸ SLC1A1 P43005 1/20 0.49
▸ FOLH1 Q04609 1/20 0.49
▸ CPB1 P15086 1/20 0.49
▸ CPB2 Q96IY4 1/20 0.49
▸ MMP1 P03956 2/20 0.48
▸ MMP2 P08253 1/20 0.48
▸ MMP7 P09237 1/20 0.48
▸ MMP9 P14780 1/20 0.48
▸ MMP12 P39900 1/20 0.48
▸ MMP13 P45452 1/20 0.48

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
SCHEMBL3928753 0.85 CYP1A2 (0.70) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL28126947 0.84 CYP1A2 (0.57) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL18623970 0.82 CYP1A2 (0.55) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL28411865 0.81 CYP1A2 (0.53) CYP1A2MMECPA1CPA3FOLH1
SCHEMBL12494053 0.81 CYP1A2 (0.63) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL19483376 0.81 CYP1A2 (0.53) CYP1A2MMECPA1CPA3SLC1A3
SCHEMBL23658187 0.79 CYP1A2 (0.52) CYP1A2MMECPA1CPA3FOLH1
SCHEMBL17087653 0.79 CYP1A2 (0.52) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL14874554 0.78 HSD17B10 (0.56) ANPEPRNPEPDNPEPCYP1A2MME
SCHEMBL8345051 0.78 HSD17B10 (0.56) ANPEPRNPEPDNPEPCYP1A2MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11896704-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes LUBRIZOL ADVANCED MATERIALS, INC. (US) 2024-02-13 — — US disclosed
US-10035820-B2 Compounds which inhibit neuronal exocytosis LUBRIZOL ADVANCED MATERIALS, INC (US) 2018-07-31 — — US disclosed
US-20170298097-A1 Peptide Derivatives and Uses Thereof NOSOPHARM (FR) 2017-10-19 — — US disclosed
US-9771392-B2 Compounds which inhibit neuronal exocytosis LUBRIZOL ADVANCED MATERIALS, INC. (US) 2017-09-26 — — US disclosed
US-20170218015-A1 PROCESS FOR THE LIQUID PHASE SYNTHESIS OF H-INP-(D)BAL-(D)TRP-PHE-APC-NH2, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF ALLERGAN GI CORP. 2017-08-03 — — US disclosed
US-20170101438-A1 COSMETIC OR PHARMACEUTICAL METHODS FOR THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR USING TRIPEPTIDES CAPABLE OF STIMULATING CYCLIC ADENOSINE MONOPHOSPHATE SYNTHESIS LIPOTEC, S.A. 2017-04-13 — — US disclosed
US-20150183823-A1 COSMETIC OR PHARMACEUTICAL COMPOSITIONS INCLUDING TRIPEPTIDES CAPABLE OF STIMULATING CYCLIC ADENOSINE MONOPHOSPHATE SYNTHESIS AND THEIR USE IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR LIPOTEC, S.A. 2015-07-02 — — US disclosed
US-20150140046-A1 COMPOUNDS WHICH INHIBIT NEURONAL EXOCYTOSIS LUBRIZOL ADVANCED MATERIALS, INC. 2015-05-21 — — US disclosed
US-20150098989-A1 COMPOUNDS WHICH INHIBIT NEURONAL EXOCYTOSIS LUBRIZOL ADVANCED MATERIALS, INC. 2015-04-09 — — US disclosed
US-8653278-B2 Isoform selective HDAC inhibitors GEORGETOWN UNIVERSITY (US) 2014-02-18 — — US disclosed
US-20120021029-A1 PEPTIDES USED IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS LIPOTEC, S.A. (ES) 2012-01-26 — — 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 (9 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-20150098989-A1 COMPOUNDS WHICH INHIBIT NEURONAL EXOCYTOSIS SLC18A2, SLC18A1, ATP6V1B2 ANPEP 1013/4885RNPEP 1233/4885DNPEP 1574/4885
US-11896704-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, MTX1, MTX2 ANPEP 188/4885RNPEP 911/4885DNPEP 839/4885
US-20150183823-A1 COSMETIC OR PHARMACEUTICAL COMPOSITIONS INCLUDING TRIPEPTIDES CAPABLE OF STIMULATING CYCLIC ADENOSINE MONOPHOSPHATE SYNTHESIS AND THEIR USE IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR MC1R, ADORA3, AMPD3 ANPEP 87/4885RNPEP 145/4885DNPEP 358/4885
US-20170218015-A1 PROCESS FOR THE LIQUID PHASE SYNTHESIS OF H-INP-(D)BAL-(D)TRP-PHE-APC-NH2, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF VIP, IAPP, PROKR1 ANPEP 64/4885RNPEP 225/4885DNPEP 90/4885
US-20170101438-A1 COSMETIC OR PHARMACEUTICAL METHODS FOR THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR USING TRIPEPTIDES CAPABLE OF STIMULATING CYCLIC ADENOSINE MONOPHOSPHATE SYNTHESIS MC1R, ADORA3, AMPD3 ANPEP 58/4885RNPEP 82/4885DNPEP 255/4885
US-10035820-B2 Compounds which inhibit neuronal exocytosis SLC18A2, SLC18A1, ATP6V1B2 ANPEP 1013/4885RNPEP 1233/4885DNPEP 1574/4885
US-20120021029-A1 PEPTIDES USED IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS NGLY1, MC1R, NPR3 ANPEP 86/4885RNPEP 84/4885DNPEP 275/4885
US-20170298097-A1 Peptide Derivatives and Uses Thereof VIP, IAPP, NGLY1 ANPEP 12/4885RNPEP 58/4885DNPEP 13/4885
US-20150140046-A1 COMPOUNDS WHICH INHIBIT NEURONAL EXOCYTOSIS SLC18A2, SLC18A1, ATP6V1B2 ANPEP 1053/4885RNPEP 1370/4885DNPEP 1576/4885

“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.

Send feedback