SCHEMBL25675441

SCHEMBL25675441

Bc1ccc2nc(C)c(C)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE10A Q9Y233 1/20 0.36
KDM4E B2RXH2 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
STAT3 P40763 1/20 0.34
TERT O14746 1/20 0.33
MBNL1 Q9NR56 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
NQO2 P16083 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL862359 0.78 MEN1 (0.56) PSMB5MEN1KMT2AKDM4ETDP1
SCHEMBL8643542 0.75 ALDH1A1 (0.49) MEN1KMT2APDE10AKDM4EMAPT
SCHEMBL27910453 0.75 TTR (0.46) MEN1KMT2APDE10AKDM4ETDP1
SCHEMBL12827021 0.75 TSHR (0.51) MEN1KMT2APDE10AKDM4EMAPT
SCHEMBL12500744 0.75 KDM4E (0.57) MEN1KMT2APDE10AKDM4EMAPT
SCHEMBL12597248 0.72 CYP1A2 (0.63) MEN1KMT2AKDM4ECYP1A2
SCHEMBL9797601 0.72 TERT (0.46) MEN1KMT2APDE10AKDM4ETDP1
SCHEMBL13238155 0.72 KDM4E (0.59) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL12231918 0.72 PSMB5 (0.52) PSMB5MEN1KMT2APDE10AKDM4E
SCHEMBL422035 0.71 ALDH1A1 (0.63) MEN1KMT2APDE10AKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685737-B2 Fluorinated integrin antagonists OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 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 (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-11685737-B2 Fluorinated integrin antagonists ITGB5, ITGB1, ITGA5 PSMB5 2023/4885MEN1 3906/4885KMT2A 4143/4885

“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.