SCHEMBL2425657

SCHEMBL2425657

CC(C)(C)OC(=O)N1CCN(c2ccc(C(F)(F)F)cc2C=C2SC(=O)NC2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 5/20 0.49
▸ PIM1 P11309 4/20 0.49
▸ PIM2 Q9P1W9 4/20 0.49
▸ PIM3 Q86V86 2/20 0.49
▸ NR1H4 Q96RI1 1/20 0.47
▸ PTPN1 P18031 5/20 0.45
▸ TTR P02766 1/20 0.44
▸ CISD1 Q9NZ45 1/20 0.44
▸ ESRRA P11474 4/20 0.44
▸ MAPT P10636 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42

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
SCHEMBL2425656 1.00 GPR119 (0.49) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL13537962 0.94 GPR119 (0.49) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2426618 0.89 PIM1 (0.45) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2426616 0.89 PIM1 (0.45) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL12282967 0.87 GPR119 (0.51) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2423844 0.85 PIM1 (0.48) PIM1PIM2PIM3NR1H4PTPN1
SCHEMBL2423842 0.85 PIM1 (0.48) PIM1PIM2PIM3NR1H4PTPN1
SCHEMBL2424864 0.84 PIM1 (0.66) GPR119PIM1PIM2PIM3TTR
SCHEMBL2428104 0.84 PIM1 (0.66) GPR119PIM1PIM2PIM3TTR
SCHEMBL12282352 0.82 PIM1 (0.46) PIM1PIM2PIM3NR1H4PTPN1

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-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 — — US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 — — US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 — — 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 (2 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-20110218182-A1 CHEMICAL COMPOUNDS 251 PIM1, PIM3, PIM2 GPR119 1748/4885PIM1 1/4885PIM2 3/4885
US-20150051185-A1 Chemical Compounds 251 PIM1, PIM3, PIM2 GPR119 1733/4885PIM1 1/4885PIM2 3/4885

“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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