SCHEMBL9918555

SCHEMBL9918555

C=C1COc2ccc(Nc3c(C(N)=O)nnc4[nH]ccc34)cc2N1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.36
KMT2A Q03164 2/20 0.34
LRRK2 Q5S007 2/20 0.34
JAK1 P23458 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
JAK2 O60674 2/20 0.33
TYK2 P29597 1/20 0.33
MAPK9 P45984 1/20 0.32
MAPK10 P53779 1/20 0.32
PTK2 Q05397 1/20 0.32
TRPV1 Q8NER1 2/20 0.31
JAK3 P52333 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
POLB P06746 1/20 0.31
KCNH2 Q12809 1/20 0.30
ADRB2 P07550 1/20 0.30

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
SCHEMBL9921974 0.89 ALDH1A1 (0.44) SYKKMT2AJAK1ALDH1A1MAPT
SCHEMBL9918557 0.82 LRRK2 (0.33) SYKLRRK2JAK1ALDH1A1JAK3
SCHEMBL9918562 0.79 SYK (0.47) SYKLRRK2POLBKCNH2HTR1A
SCHEMBL9921982 0.79 KDM4E (0.44) SYKLRRK2JAK1ALDH1A1JAK3
SCHEMBL9918558 0.74 HTT (0.41) KMT2ALRRK2ALDH1A1MAPTTRPV1
SCHEMBL9918560 0.73 JAK2 (0.34) SYKLRRK2JAK1JAK2TYK2
SCHEMBL12833307 0.69 LRRK2 (0.43) SYKLRRK2MAPTKCNH2
SCHEMBL9918556 0.69 ALDH1A1 (0.36) KMT2AJAK1ALDH1A1MAPTJAK2
SCHEMBL9920237 0.69 JAK2 (0.46) JAK1JAK2TYK2JAK3
SCHEMBL9918545 0.69 CSF1R (0.46) KMT2ALRRK2ALDH1A1MAPTMEN1

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-20120149662-A1 Heterocyclic Compounds as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149662-A1 Heterocyclic Compounds as Janus Kinase Inhibitors JAK2, JAK1, JAK3 SYK 87/4885KMT2A 628/4885LRRK2 1567/4885

“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.