SCHEMBL1096205

SCHEMBL1096205

O=C(O)[C@H](Cc1ccc(Cl)cc1)NCc1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CA2 P00918 1/20 0.50
PPARG P37231 4/20 0.49
ADAMTS5 Q9UNA0 1/20 0.49
MMP2 P08253 1/20 0.49
EPHX2 P34913 1/20 0.49
PPARA Q07869 2/20 0.49
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
TSHR P16473 1/20 0.47
FFAR1 O14842 1/20 0.46
FOLH1 Q04609 1/20 0.45

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
SCHEMBL11342559 0.95 ADAMTS5 (0.56) ALDH1A1LMNAPPARGADAMTS5MMP2
SCHEMBL11344065 0.95 ADAMTS5 (0.56) ALDH1A1LMNAPPARGADAMTS5MMP2
SCHEMBL11351933 0.94 NHERF1 (0.49) ALDH1A1LMNAKMT2AMEN1CA2
SCHEMBL11351930 0.94 NHERF1 (0.49) ALDH1A1LMNAKMT2AMEN1CA2
SCHEMBL11352174 0.91 NAMPT (0.49) ALDH1A1LMNACA2PPARGADAMTS5
SCHEMBL28805317 0.86 ALDH1A1 (0.51) ALDH1A1LMNAKMT2AMEN1CYP2C9
SCHEMBL29855078 0.85 PPARG (0.50) ALDH1A1LMNAKMT2ACA2PPARG
SCHEMBL8003721 0.85 ALDH1A1 (0.54) ALDH1A1LMNAKMT2AMEN1PPARG
SCHEMBL148423 0.84 FOLH1 (0.55) ALDH1A1KMT2AMEN1CA2FOLH1
SCHEMBL8414223 0.84 FOLH1 (0.55) ALDH1A1KMT2AMEN1CA2FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153365-B2 Oligonucleotide analogues EXIQON A/S (DK) 2012-04-10 US disclosed
US-8034909-B2 Oligonucleotide analogues EXIQON A/S (DK) 2011-10-11 US disclosed
US-20110245327-A1 Oligonucleotide Analogues EXIQON A/S (DK) 2011-10-06 US disclosed
EP-2341057-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP disclosed
EP-2341058-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP disclosed
US-20080227847-A1 Novel Salts of Fumaric Acid Monoalkylesters and Their Pharmaceutical Use ADITECH PHARMA AB (SE) 2008-09-18 US disclosed
US-6376655-B1 APPLYING EXTERNAL STIMULATION; OPTICAL ANISOTROPY RISO NATIONAL LABORATORY (DK) 2002-04-23 US disclosed
EP-0031653-A1 N-Substituted alpha-amino acids, processes for making them and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1981-07-08 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-20110245327-A1 Oligonucleotide Analogues POLRMT, POLM, POLN ALDH1A1 3811/4885LMNA 496/4885KMT2A 3747/4885
US-20080227847-A1 Novel Salts of Fumaric Acid Monoalkylesters and Their Pharmaceutical Use FAH, SLC16A1, FH ALDH1A1 320/4885LMNA 4645/4885KMT2A 1273/4885

“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.