SCHEMBL20975490

SCHEMBL20975490

CCOC(=O)Cn1ccc2ccc(Cl)nc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 3/20 0.47
TSHR P16473 2/20 0.43
LMNA P02545 1/20 0.43
TNF P01375 3/20 0.42
RAB9A P51151 2/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
JAK3 P52333 1/20 0.40
CYP1A2 P05177 1/20 0.39

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
SCHEMBL20975450 0.81 KDM4E (0.47) KDM4EALDH1A1TSHRLMNATNF
SCHEMBL20975437 0.80 KDM4E (0.52) KDM4EALDH1A1TSHRLMNATNF
SCHEMBL20975444 0.79 KDM4E (0.45) KDM4EALDH1A1TSHRLMNATNF
SCHEMBL31306259 0.74 TNF (0.51) KDM4EALDH1A1TSHRLMNATNF
SCHEMBL12636575 0.72 FPR2 (0.46) KDM4EALDH1A1TSHRLMNARAB9A
SCHEMBL29958540 0.72 KMO (0.55) ALDH1A1TSHRLMNAHTTMEN1
SCHEMBL5143014 0.72 KMO (0.55) ALDH1A1TSHRLMNAHTTMEN1
SCHEMBL26912368 0.72 APOBEC3A (0.42) KDM4EALDH1A1TNFRAB9AHTT
SCHEMBL18955878 0.72 PSMB1 (0.58) KDM4EALDH1A1LMNATNFMEN1
SCHEMBL15819715 0.70 JAK1 (0.58) ALDH1A1RAB9AHTTMEN1MAPT

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-20210107896-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same UNIV YALE (US) 2021-04-15 US disclosed
US-10899739-B2 Macrophage migration inhibitory factor inhibitors, and methods of making and using same YALE UNIVERSITY (US) 2021-01-26 US disclosed
US-20190144424-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same YALE UNIVERSITY 2019-05-16 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 (3 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-20210107896-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same MIF, MMP12, METAP1 KDM4E 651/4885ALDH1A1 2061/4885TSHR 3788/4885
US-20190144424-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same MIF, MMP12, METAP1 KDM4E 651/4885ALDH1A1 2061/4885TSHR 3788/4885
US-10899739-B2 Macrophage migration inhibitory factor inhibitors, and methods of making and using same MIF, MMP12, METAP1 KDM4E 651/4885ALDH1A1 2061/4885TSHR 3788/4885

“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.