SCHEMBL2496535

SCHEMBL2496535

COc1ccc(C)cc1C1(O)C(=O)Nc2ccc(C#N)cc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ALOX12 P18054 1/20 0.43
AR P10275 3/20 0.42
ALK Q9UM73 4/20 0.42
BRD4 O60885 3/20 0.41
PGR P06401 1/20 0.39
USP2 O75604 2/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.36
ESRRA P11474 1/20 0.36

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
SCHEMBL2679629 0.86 KMT2A (0.67) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL2497668 0.82 KMT2A (0.51) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL2497604 0.82 KMT2A (0.51) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL2496439 0.82 KMT2A (0.51) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL2496912 0.80 KMT2A (0.74) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL17260274 0.79 AVPR1B (0.44) KMT2AALKBRD4PGR
SCHEMBL2498887 0.78 ALDH1A1 (0.48) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL11042537 0.76 KMT2A (0.47) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL2495393 0.75 KMT2A (0.57) KMT2ABRD4ACHEADAMTS5
SCHEMBL2495299 0.74 MAPT (0.45) KMT2ALMNAKDM4EALDH1A1GAA

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 KMT2A 1662/4885LMNA 3349/4885KDM4E 1528/4885

“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.