SCHEMBL6154384

SCHEMBL6154384

CC(NC(=O)OCc1ccccc1)(C(=O)O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CTSS P25774 2/20 0.49
SYK P43405 1/20 0.49
LMNA P02545 2/20 0.49
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTRB1 P17538 2/20 0.48
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
POLB P06746 1/20 0.47
HTT P42858 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
SCHEMBL6154376 1.00 MEN1 (0.55) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL27791880 0.86 MEN1 (0.56) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL503402 0.84 MEN1 (0.57) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL6380611 0.84 MEN1 (0.57) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL4442846 0.83 KMT2A (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL8889711 0.82 MEN1 (0.50) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL5500086 0.82 KMT2A (0.55) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL20382395 0.82 KMT2A (0.62) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL1455608 0.82 MEN1 (0.56) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL31329448 0.82 CYP1A2 (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10117860-B2 Aminoester derivatives CHIESI FARMACEUTICI S.P.A. (IT) 2018-11-06 US disclosed
EP-3152201-B1 AMINOESTER DERIVATIVES CHIESI FARM SPA (IT) 2018-08-29 EP disclosed
US-20170340616-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-20170340616-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-9763924-B2 Aminoester derivatives CHIESI FARMACEUTICI S.P.A. (IT) 2017-09-19 US disclosed
US-9763924-B2 Aminoester derivatives CHIESI FARMACEUTICI S.P.A. (IT) 2017-09-19 US disclosed
US-9763924-B2 Aminoester derivatives CHIESI FARMACEUTICI S.P.A. (IT) 2017-09-19 US disclosed
EP-3152201-A1 AMINOESTER DERIVATIVES Chiesi Farmaceutici S.p.A. (IT) 2017-04-12 EP disclosed
WO-2015185649-A9 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2017-01-05 WO disclosed
WO-2015185649-A9 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2017-01-05 WO disclosed
US-20150352091-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 US disclosed
US-20150352091-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 US disclosed
US-20150352091-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 US disclosed
WO-2015185649-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 WO disclosed
WO-2015185649-A1 AMINOESTER DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 WO disclosed
EP-1078919-B1 SYNTHESIS OF ALPHA-AMINO-ALPHA',ALPHA'-DIHALOKETONES AND PROCESS FOR THE PREPARATION OF BETA)-AMINO ACID DERIVATIVES BY THE USE OF THE SAME KANEKA CORP (JP) 2005-12-07 EP disclosed
US-20030158436-A1 Synthesis of alpha--amino-alpha, alpha'- dihaloketones and process for the preparation of beta--amino acid derivatives by the use of the same KANEKA CORPORATION 2003-08-21 US disclosed
US-6573399-B1 Reacting an alpha -amino acid ester derivative with a base and a dihalomethane KANEKA CORPORATION (JP) 2003-06-03 US disclosed
EP-1078919-A1 SYNTHESIS OF $g(a)-AMINO-$g(a)',$g(a)'-DIHALOKETONES AND PROCESS FOR THE PREPARATION OF $g(b)-AMINO ACID DERIVATIVES BY THE USE OF THE SAME KANEKA CORPORATION (JP) 2001-02-28 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-20030158436-A1 Synthesis of alpha--amino-alpha, alpha'- dihaloketones and process for the preparation of beta--amino acid derivatives by the use of the same AADAT, BCAT1, AASDHPPT MEN1 843/4885KMT2A 1205/4885SMN1; SMN2 4483/4885
US-20170340616-A1 AMINOESTER DERIVATIVES PDE4A, PDE4B, PDE3A MEN1 3881/4885KMT2A 1424/4885SMN1; SMN2 4068/4885
US-20150352091-A1 AMINOESTER DERIVATIVES PDE4A, PDE4B, PDE3A MEN1 3881/4885KMT2A 1424/4885SMN1; SMN2 4068/4885
US-10117860-B2 Aminoester derivatives PDE4A, PDE4B, PDE3A MEN1 3881/4885KMT2A 1424/4885SMN1; SMN2 4068/4885

“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.