SCHEMBL8399191

SCHEMBL8399191

CCOC(=O)C(C#N)(CO)CO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 1/20 0.48
PKM P14618 3/20 0.44
KDM4E B2RXH2 2/20 0.44
SOAT1 P35610 1/20 0.39
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
HTT P42858 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL1963 0.85 ALDH1A1 (0.50) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL7722774 0.82 MEN1 (0.52) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL8397276 0.81 ALDH1A1 (0.44) ALDH1A1TSHRLMNA
SCHEMBL8399193 0.80 ALDH1A1 (0.37) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL14016347 0.80 MEN1 (0.46) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL7515108 0.79 MEN1 (0.44) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL2410161 0.79 MMP8 (0.49) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL7709450 0.79 MEN1 (0.49) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL18290151 0.79 MEN1 (0.68) MEN1KMT2AALDH1A1TSHRPKM
SCHEMBL1026522 0.79 MEN1 (0.44) MEN1KMT2AALDH1A1TSHRPKM

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-5932747-A Method for preparing 1,3-dioxane compounds HUELS AKTIENGESELLSCHAFT (DE) 1999-08-03 US claimed
US-5902896-A Process for preparing bis (hydroxymethyl) compounds HUELS AKTIENGESELLSCHAFT (DE) 1999-05-11 US claimed
US-20240140957-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEONE MEDICINES I GMBH (CH) 2024-05-02 US disclosed
WO-2022148422-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEIGENE, LTD. (KY) 2022-07-14 WO disclosed
EP-2276772-B1 BORON OR ALUMINUM COMPLEXES CENTRE NAT RECH SCIENT (FR) 2014-08-20 EP disclosed
US-8563761-B2 Boron or aluminum complexes CENTRE NATIONAL DE LA RECHERCHE (FR) 2013-10-22 US disclosed
US-20110171112-A1 BORON OR ALUMINUM COMPLEXES UNIVERSITE DE PICARDIE JULES VERNE (FR) 2011-07-14 US disclosed
CN-102060732-A 5-amino-4-hydroxy-N-aryl azelamide derivatives as well as preparation methods and medical applications thereof JIANGSU HENGRUI MEDICINE CO 2011-05-18 CN disclosed
WO-2009122044-A2 BORON OR ALUMINUM COMPLEXES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-10-08 WO disclosed
US-5932747-A Method for preparing 1,3-dioxane compounds HUELS AKTIENGESELLSCHAFT (DE) 1999-08-03 US disclosed
US-5902896-A Process for preparing bis (hydroxymethyl) compounds HUELS AKTIENGESELLSCHAFT (DE) 1999-05-11 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 (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-20240140957-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF KRAS, NRAS, G3BP1 MEN1 130/4885KMT2A 1301/4885ALDH1A1 3389/4885
US-20110171112-A1 BORON OR ALUMINUM COMPLEXES AFF4, AFF2, AFF1 MEN1 3452/4885KMT2A 3346/4885ALDH1A1 4333/4885

“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.