SCHEMBL2956487

SCHEMBL2956487

O=c1c2[nH]cnc2cnn1COCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
IP6K1 Q92551 1/20 0.41
CDC7 O00311 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
ADORA3 P0DMS8 4/20 0.38
ADORA2B P29275 4/20 0.38
PNP P00491 2/20 0.37
PDE4A P27815 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CYP1A2 P05177 2/20 0.36
LMNA P02545 1/20 0.36
CDK1 P06493 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CCNB1 P14635 1/20 0.36
MGMT P16455 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
SCHEMBL27093489 0.76 ALDH1A1 (0.39) MAPTKMT2ALMNACYP2C9TSHR
SCHEMBL1221642 0.72 TSHR (0.39) MAPTKMT2ALMNATSHRMAPK14
SCHEMBL9123335 0.72 HTT (0.59) MAPTKMT2ACYP1A2LMNACYP3A4
SCHEMBL23122482 0.70 ALDH1A1 (0.50) MAPTKMT2ACYP1A2LMNACYP3A4
SCHEMBL5776466 0.70 MGLL (0.45) MAPT
SCHEMBL15885153 0.69 NR2E3 (0.55) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL9124696 0.69 NPBWR1 (0.40) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL29918479 0.69 DPP4 (0.51) MAPTADORA3ADORA2BPDE4APDE4B
SCHEMBL8885140 0.68 TSHR (0.39) MAPTKMT2ACYP1A2LMNATSHR
SCHEMBL15884968 0.68 ALDH1A1 (0.47) MAPTKMT2ACYP1A2LMNACYP3A4

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-7772226-B2 Condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-15 US disclosed
EP-1514552-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE Eisai Co., Ltd. (JP) 2005-03-16 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 (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-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES DPP4, HDAC1, DPP7 MAPT 4084/4885IP6K1 757/4885CDC7 823/4885

“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.