SCHEMBL19458017

SCHEMBL19458017

O=C(c1ccc(C(=O)C(Cl)Cl)o1)C(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.40
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA2 P00918 1/20 0.31
CAMK2A Q9UQM7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PDK1 Q15118 2/20 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
SCHEMBL16522849 0.74 KDM4E (0.40) MAPTPKMHSD17B10TDP1LMNA
SCHEMBL12431217 0.72 KMT2A (0.60) MAPTPKMHSD17B10TDP1MEN1
SCHEMBL1355720 0.69 MAPT (0.39) MAPTPKMHSD17B10TDP1MEN1
SCHEMBL31186169 0.69 PDPK1 (0.70) PDPK1TDP1LMNAMEN1KMT2A
SCHEMBL8171942 0.67 CA1 (0.57) PDPK1MAPTMEN1KMT2ACA2
SCHEMBL19829835 0.67 PDPK1 (0.53) PDPK1KMT2ACA2PDK1
SCHEMBL10161062 0.67 TDP1 (0.45) HSD17B10TDP1MEN1KMT2AALDH1A1
SCHEMBL21729382 0.66 KDM4E (0.34) TDP1MEN1KMT2ACYP1A2CYP2C19
SCHEMBL8385131 0.66 ALDH1A1 (0.57) PDPK1MAPTTDP1LMNACYP2C19
SCHEMBL11904537 0.65 TDP1 (0.61) HSD17B10TDP1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3231795-B1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND NINGBO INST MATERIALS TECH & ENG CAS (CN) 2021-09-15 EP disclosed
CN-112409305-A Preparation method of 2, 5-diacyl furan compound 中国科学院宁波材料技术与工程研究所 2021-02-26 CN disclosed
US-10125110-B2 Method for preparing 2,5-disubstituted furan compound NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2018-11-13 US disclosed
US-20170320844-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2017-11-09 US disclosed
EP-3231795-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND Ningbo Institute Of Material Technology And Engineering Chinese Academy of Sciences (CN) 2017-10-18 EP disclosed
CN-105732546-A Preparation method of 2, 5-diacyl furan compound 中国科学院宁波材料技术与工程研究所 2016-07-06 CN 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-20170320844-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND ALOX5, PFAS, APEH PDPK1 3843/4885MAPT 4456/4885PKM 3126/4885
US-10125110-B2 Method for preparing 2,5-disubstituted furan compound ALOX5, PFAS, APEH PDPK1 3843/4885MAPT 4456/4885PKM 3126/4885

“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.