SCHEMBL22401192

SCHEMBL22401192

Cc1c(C(=O)O)c2cccnc2n1[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.45
▸ DDB1 Q16531 1/20 0.44
▸ CRBN Q96SW2 1/20 0.44
▸ EZH2 Q15910 8/20 0.44
▸ MMP13 P45452 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ TLR9 Q9NR96 1/20 0.41
▸ TLR8 Q9NR97 1/20 0.41
▸ TLR7 Q9NYK1 1/20 0.41

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
SCHEMBL22401193 1.00 GPR119 (0.45) GPR119DDB1CRBNEZH2MMP13
SCHEMBL23672111 0.90 GPR119 (0.45) GPR119DDB1CRBNEZH2POLB
SCHEMBL23672113 0.90 GPR119 (0.45) GPR119DDB1CRBNEZH2POLB
SCHEMBL16344622 0.85 EZH2 (0.43) GPR119EZH2TLR9TLR8TLR7
SCHEMBL16344544 0.85 EZH2 (0.51) EZH2
SCHEMBL16376984 0.84 EZH2 (0.49) GPR119EZH2
SCHEMBL16493262 0.84 EZH2 (0.49) GPR119EZH2
SCHEMBL16347153 0.84 EZH2 (0.49) GPR119EZH2
SCHEMBL16347151 0.84 EZH2 (0.49) GPR119EZH2
SCHEMBL23672116 0.83 GPR119 (0.42) GPR119MMP13

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
US-11459315-B2 Modulators of methyl modifying enzymes, compositions and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2022-10-04 — — US disclosed
EP-3707136-B1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2022-05-04 — — EP disclosed
US-20210230148-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. 2021-07-29 — — US disclosed
EP-3707136-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF Constellation Pharmaceuticals, Inc. (US) 2020-09-16 — — EP 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-11459315-B2 Modulators of methyl modifying enzymes, compositions and uses thereof TPMT, TET1, TET2 GPR119 3613/4885DDB1 2663/4885CRBN 1011/4885
US-20210230148-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF TPMT, TET1, TET2 GPR119 3613/4885DDB1 2663/4885CRBN 1011/4885

“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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