SCHEMBL2173797

SCHEMBL2173797

FCCn1ccc2cncnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 8/20 0.40
MKNK1 Q9BUB5 2/20 0.34
CYP1A2 P05177 4/20 0.33
CYP3A4 P08684 4/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MTNR1A P48039 1/20 0.33
EGFR P00533 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
LTA4H P09960 1/20 0.32
RPS6KA3 P51812 1/20 0.32
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
MEN1 O00255 1/20 0.31
CYP2D6 P10635 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 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
SCHEMBL25818492 0.86 MKNK2 (0.40) MKNK2MKNK1CYP1A2CYP3A4HSD17B10
SCHEMBL13195335 0.83 MKNK2 (0.40) MKNK2MKNK1CYP1A2MTNR1AEGFR
SCHEMBL24110604 0.79 HTR2C (0.47) MKNK2MTNR1AEGFR
SCHEMBL5068124 0.79 MKNK2 (0.42) MKNK2MKNK1CYP1A2CYP3A4HSD17B10
SCHEMBL28212561 0.78 CYP1A2 (0.47) CYP1A2CYP3A4HSD17B10USP2ALDH1A1
SCHEMBL28212072 0.75 CYP1A2 (0.45) CYP1A2CYP3A4HSD17B10USP2ALDH1A1
SCHEMBL18926936 0.75 MKNK2 (0.39) MKNK2MKNK1PRMT5WDR77RPS6KA3
SCHEMBL8817640 0.75 MKNK2 (0.39) MKNK2MKNK1HSD17B10ALDH1A1EGFR
SCHEMBL27845067 0.75 RPS6KA3 (0.36) RPS6KA3KMT2A
SCHEMBL15833690 0.74 MTNR1A (0.36) MKNK2MKNK1ALDH1A1MTNR1APRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102227422-A Heterocyclic jak kinase inhibitors ASTRAZENECA AB 2011-10-26 CN claimed
US-20110201628-A1 HETEROCYCLIC JAK KINASE INHIBITORS ASTRAZENECA AB (SE) 2011-08-18 US claimed
EP-2346859-A1 HETEROCYCLIC JAK KINASE INHIBITORS AstraZeneca AB (SE) 2011-07-27 EP claimed
WO-2010038060-A1 HETEROCYCLIC JAK KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-04-08 WO claimed

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-20110201628-A1 HETEROCYCLIC JAK KINASE INHIBITORS JAK2, JAK1, JAK3 MKNK2 164/4885MKNK1 174/4885CYP1A2 1019/4885

“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.