SCHEMBL2291968

SCHEMBL2291968

O=C(Cl)c1cc[nH]c(=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
NOTUM Q6P988 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
APOBEC3G Q9HC16 1/20 0.39
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
SMYD3 Q9H7B4 1/20 0.35
FKBP5 Q13451 1/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
ALDH2 P05091 2/20 0.33
CRBN Q96SW2 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
ENPP2 Q13822 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NSD2 O96028 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
SCHEMBL1255885 0.80 MEN1 (0.56) KMT2AMEN1NOTUMAPOBEC3GALDH1A1
SCHEMBL6163681 0.78 MEN1 (0.44) KMT2AMEN1NOTUMAPOBEC3GALDH1A1
SCHEMBL11706244 0.78 SLC2A1 (0.46) KMT2AMEN1NOTUMJAK2JAK1
SCHEMBL28872504 0.74 KMT2A (0.38) KMT2AMEN1NOTUMJAK2JAK1
SCHEMBL205408 0.74 CA1 (0.48) KMT2AMEN1ALDH1A1TSHRCA12
SCHEMBL31701218 0.74 MAPT (0.46) KMT2AMEN1ALDH1A1HPGD
SCHEMBL2896727 0.74 ALDH1A1 (0.47) KMT2AMEN1JAK2JAK1TYK2
SCHEMBL13729839 0.74 HDAC8 (0.47) JAK2JAK1TYK2APOBEC3GTSHR
SCHEMBL26336607 0.74 APOBEC3G (0.46) KMT2AMEN1NOTUMJAK2JAK1
SCHEMBL26350804 0.74 APOBEC3G (0.46) KMT2AMEN1NOTUMJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989625-B2 Thienopyridines MERCK PATENT GMBH (DE) 2011-08-02 US disclosed
US-20100048558-A1 THIENOPYRIDINES MERCK PATENT GESELLSCHAFT (DE) 2010-02-25 US disclosed
CN-101163707-A Thienopyridines MERCK PATENT GMBH (DE) 2008-04-16 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 (1 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-20100048558-A1 THIENOPYRIDINES HSP90AB2P, HSP90AB1, HSP90AA1 KMT2A 3874/4885MEN1 4504/4885NOTUM 4669/4885

“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.