SCHEMBL4885989

SCHEMBL4885989

O=C(N/N=C(\C=N\O)c1cccc(C(F)(F)F)c1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
LMNA P02545 4/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 4/20 0.47
POLB P06746 3/20 0.47
PTBP1 P26599 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 3/20 0.44
ADCY1 Q08828 1/20 0.43
GAA P10253 2/20 0.42
SRD5A2 P31213 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL4885991 1.00 KCNK3 (0.47) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4885958 0.90 LMNA (0.54) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4885965 0.90 LMNA (0.54) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4876266 0.88 KMT2A (0.48) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4876259 0.88 KMT2A (0.48) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4883201 0.86 RAB9A (0.49) LMNAKMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL4883196 0.86 RAB9A (0.49) LMNAKMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL4885748 0.83 P2RX1 (0.48) KCNK3CTSLCTSBLMNAKMT2A
SCHEMBL4877981 0.83 MAPT (0.48) LMNAKMT2AKDM4EPOLBPTBP1
SCHEMBL4882188 0.83 MAPT (0.48) LMNAKMT2AKDM4EPOLBPTBP1

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-20080227787-A1 Use of New Lipoxygenase Inhibitors BIOLIPOX AB (SE) 2008-09-18 US disclosed
EP-1725227-A1 USE OF NEW LIPOXYGENASE INHIBITORS Biolipox AB (SE) 2006-11-29 EP disclosed
WO-2005084656-A1 USE OF NEW LIPOXYGENASE INHIBITORS BIOLIPOX AB (SE) 2005-09-15 WO 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-20080227787-A1 Use of New Lipoxygenase Inhibitors ALOX15, ALOX15B, ALOX12 KCNK3 3612/4885CTSL 666/4885CTSB 896/4885

“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.