SCHEMBL214350

SCHEMBL214350

Cc1ccc(N(C(=O)c2nc[nH]c2C(N)=O)c2nc(-c3ccccc3)c[nH]2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 2/20 0.36
▸ KMO O15229 1/20 0.34
▸ KDM4E B2RXH2 6/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ LMNA P02545 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MMP9 P14780 1/20 0.33
▸ MAPT P10636 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ GAA P10253 3/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CAMKK2 Q96RR4 1/20 0.32
▸ CTRC Q99895 1/20 0.31
▸ ATR Q13535 1/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL217227 0.80 POLB (0.37) PAX8KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL213207 0.78 LMNA (0.48) KDM4EALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL215550 0.75 MAP2 (0.34) KMOKDM4ELMNASMN1; SMN2MAPT
SCHEMBL216235 0.73 KDM4E (0.38) KDM4EALDH1A1TSHRMAPTHSD17B10
SCHEMBL214851 0.73 SMN1; SMN2 (0.33) PAX8KDM4EALDH1A1LMNATSHR
SCHEMBL216492 0.73 POLB (0.37) PAX8KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL213394 0.70 POLB (0.48) KDM4EALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL214715 0.70 POLB (0.40) PAX8KDM4EALDH1A1LMNATSHR
SCHEMBL214152 0.70 ALDH1A1 (0.38) KDM4EALDH1A1TSHRSMN1; SMN2MAPT
SCHEMBL213623 0.70 MAP2 (0.36) KDM4ESMN1; SMN2TDP1

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-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 — — US claimed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 — — US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 — — 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 PAX8 4790/4885KMO 780/4885KDM4E 952/4885

“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.

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