SCHEMBL23113441

SCHEMBL23113441

Nc1cc(Cl)cc(C(=O)N2CCOCC2)c1

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.59
KDM4E B2RXH2 2/20 0.56
PKM P14618 1/20 0.55
AKR1C3 P42330 1/20 0.54
HPGD P15428 2/20 0.52
F2 P00734 2/20 0.52
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
TSHR P16473 1/20 0.48
HSP90AA1 P07900 1/20 0.47
HSD11B1 P28845 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 1/20 0.46
TP53 P04637 1/20 0.46
MDM2 Q00987 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL15695610 0.89 KDM4E (0.65) PHGDHKDM4EPKMAKR1C3HPGD
SCHEMBL14733308 0.87 KDM4E (0.62) PHGDHKDM4EPKMAKR1C3HPGD
SCHEMBL21930867 0.85 KDM4E (0.71) KDM4EHPGDF2HSD11B1SMN1; SMN2
SCHEMBL30380803 0.84 KDM4E (0.74) KDM4EHPGDF2HSP90AA1HSD11B1
SCHEMBL19097955 0.81 PHGDH (0.59) PHGDHKDM4EPKMAKR1C3HPGD
SCHEMBL23113264 0.81 HPGD (0.58) PHGDHKDM4EPKMHPGDMAPT
SCHEMBL11894194 0.79 PHGDH (0.56) PHGDHKDM4EPKMAKR1C3HPGD
SCHEMBL1013250 0.78 EPHX2 (0.52) KDM4EAKR1C3HPGDHTTTSHR
SCHEMBL31703347 0.78 KDM4E (0.51) PHGDHKDM4EPKMHPGDF2
SCHEMBL30584223 0.78 EPHX2 (0.52) KDM4EAKR1C3HPGDHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530193-B2 Kinase inhibitors THE UNIVERSITY OF MANCHESTER (GB) 2022-12-20 US disclosed
EP-3793996-A1 KINASE INHIBITORS The University of Manchester (GB) 2021-03-24 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 (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-11530193-B2 Kinase inhibitors CAMKK2, CAMK1, CAMKK1 PHGDH 939/4885KDM4E 1899/4885PKM 465/4885

“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.