SCHEMBL12848884

SCHEMBL12848884

O=C(Nc1cc2c(cn1)-c1cc(-c3cccnc3)ccc1CCC2)c1c(F)cccc1F

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.45
▸ GCK P35557 1/20 0.44
▸ GSK3B P49841 4/20 0.42
▸ DYRK1A Q13627 4/20 0.42
▸ ABL1 P00519 1/20 0.42
▸ ABCB1 P08183 3/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ IL2 P60568 3/20 0.42
▸ ATM Q13315 1/20 0.41
▸ DEGS1 O15121 1/20 0.40

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
SCHEMBL12848888 0.85 LMNA (0.43) LMNAGSK3BDYRK1AABCB1CYP11B1
SCHEMBL12848953 0.84 ADORA2B (0.44) LMNAGSK3BDYRK1AABL1ABCB1
SCHEMBL12796670 0.83 ABCB1 (0.42) GCKDYRK1AABCB1CYP11B1CYP11B2
SCHEMBL12848829 0.82 LMNA (0.49) LMNAGSK3BDYRK1AABL1ABCB1
SCHEMBL12796628 0.80 LMNA (0.44) LMNADYRK1AABCB1CYP11B1CYP11B2
SCHEMBL449982 0.77 IL2 (0.63) LMNAABL1ABCB1IL2DEGS1
SCHEMBL439102 0.77 ABCB1 (0.49) LMNADYRK1AABCB1ALDH1A1IL2
SCHEMBL12848831 0.77 DYRK1A (0.46) LMNAGSK3BDYRK1AABL1ABCB1
SCHEMBL11911923 0.75 IL2 (0.65) LMNAIL2
SCHEMBL12796659 0.75 ABCB1 (0.46) ABL1ABCB1CYP11B1CYP11B2DEGS1

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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2011-03-03 — — US disclosed
WO-2009089305-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2009-07-16 — — WO 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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES TSLP, NFATC1, IL5 LMNA 4871/4885GCK 1648/4885GSK3B 1985/4885

“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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