SCHEMBL5667200

SCHEMBL5667200

O=C(NN1CCCC1)c1sc2c(ccc(=O)n2-c2ccccc2)c1Nc1ccc(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
EEF2K O00418 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 2/20 0.34
KMT2A Q03164 1/20 0.34
MPI P34949 2/20 0.33
PHOSPHO1 Q8TCT1 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PMM2 O15305 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
TLR9 Q9NR96 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
G6PD P11413 1/20 0.33
CSF1R P07333 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
SCHEMBL2955571 0.88 ALDH1A1 (0.43) ALDH1A1EEF2KPOLBMAPTHTT
SCHEMBL2950047 0.86 HTR3A (0.44) ALDH1A1KMT2AKDM4ECSF1R
Ammonia Solution, Strong SCHEMBL2949465 0.85 ALDH1A1 (0.44) ALDH1A1POLBMAPTHTTTP53
SCHEMBL1267170 0.85 ALDH1A1 (0.44) ALDH1A1POLBMAPTHTTTP53
SCHEMBL2949772 0.84 ALDH1A1 (0.43) ALDH1A1POLBMAPTHTTTP53
Lithium Ion SCHEMBL1267169 0.83 ALDH1A1 (0.42) ALDH1A1POLBMAPTHTTTP53
SCHEMBL2951962 0.82 ALDH1A1 (0.41) ALDH1A1POLBMAPTTP53SMN1; SMN2
SCHEMBL5667484 0.82 ALDH1A1 (0.38) ALDH1A1
SCHEMBL5668095 0.82 ALDH1A1 (0.38) ALDH1A1
SCHEMBL5667034 0.82 ALDH1A1 (0.38) ALDH1A1

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-20060247269-A1 Thienopyridone derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2006-11-02 US claimed
US-20060247269-A1 Thienopyridone derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2006-11-02 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-20060247269-A1 Thienopyridone derivatives as kinase inhibitors MAPKAPK2, MAP3K6, MAP3K12 ALDH1A1 2307/4885CNR1 2013/4885CNR2 1591/4885

“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.