SCHEMBL4929206

SCHEMBL4929206

[CH2]C(O)CCCCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
TRPV1 Q8NER1 1/20 0.36
TRPA1 O75762 1/20 0.36
BLM P54132 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4C Q9H3R0 2/20 0.31
KDM4A O75164 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
CA1 P00915 1/20 0.31
PTPN1 P18031 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL27822327 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL4931822 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL15873598 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL4930442 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL27841585 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL1258066 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL15873627 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL4926969 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL21774118 0.97 LMNA (0.46) LMNATRPV1TRPA1BLMMEN1
SCHEMBL11711042 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014108526-A1 SYNTHETIC PROCESS FOR THE MANUFACTURE OF PIPECOLIDEPSIN COMPOUNDS PHARMA MAR, S.A. (ES) 2014-07-17 WO disclosed
EP-1120407-B1 Cystine derivatives AJINOMOTO KK (JP) 2013-02-20 EP disclosed
US-20080119551-A1 SKIN COSMETICS COMPRISING A CYSTINE DERIVATIVE AND A CHEMICAL PEELING AGENT, A BACTERICIDE, AN ANIONIC SUFACTANT, OR A CATIONIC SURFACTANT AJINOMOTO CO. INC (JP) 2008-05-22 US disclosed
US-7375085-B1 Melanocyte-stimulating hormone inhibitors AJINOMOTO CO., INC. (JP) 2008-05-20 US disclosed
US-7105570-B2 Cysteine derivatives AJINOMOTO CO., INC. (JP) 2006-09-12 US disclosed
US-20040156802-A1 Cosmetics or external preparations for skin AJINOMOTO CO., INC. (JP) 2004-08-12 US disclosed
US-6703031-B1 OXIDATIVE STRESS INHIBITOR; RETARDING AGING OF SKIN AJINOMOTO CO., INC. (JP) 2004-03-09 US disclosed
EP-1374831-A1 COMSETICS OR EXTERNAL PREPARAIOTNS FOR SKIN Ajinomoto Co., Inc. (JP) 2004-01-02 EP disclosed
US-20030194417-A1 Cysteine derivatives AJINOMOTO CO. INC (JP) 2003-10-16 US disclosed
US-6602492-B2 Cysteine derivatives AJINOMOTO CO., INC. (JP) 2003-08-05 US disclosed
US-20020115723-A1 Cysteine derivatives AJINOMOTO CO., INC. (JP) 2002-08-22 US disclosed
EP-1174437-A1 MELANOCYTE-STIMULATING HORMONE INHIBITORS Ajinomoto Co., Inc. (JP) 2002-01-23 EP disclosed
EP-1120407-A1 CYSTEINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2001-08-01 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 (4 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-20040156802-A1 Cosmetics or external preparations for skin CUTA, PSAP, CTH LMNA 2614/4885TRPV1 49/4885TRPA1 38/4885
US-20020115723-A1 Cysteine derivatives NFE2L2, GCLC, KEAP1 LMNA 4321/4885TRPV1 1439/4885TRPA1 370/4885
US-20030194417-A1 Cysteine derivatives NFE2L2, GCLC, KEAP1 LMNA 4321/4885TRPV1 1439/4885TRPA1 370/4885
US-20080119551-A1 SKIN COSMETICS COMPRISING A CYSTINE DERIVATIVE AND A CHEMICAL PEELING AGENT, A BACTERICIDE, AN ANIONIC SUFACTANT, OR A CATIONIC SURFACTANT CUTA, CTH, SRM LMNA 3363/4885TRPV1 211/4885TRPA1 77/4885

“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.