SCHEMBL6784153

SCHEMBL6784153

O=C1CCC=C1c1ncc[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.37
MTOR P42345 1/20 0.37
ADK P55263 1/20 0.37
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 2/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
BRD4 O60885 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
IDO1 P14902 1/20 0.33
CSNK1A1 P48729 1/20 0.33
TYRO3 Q06418 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
SMPD3 Q9NY59 1/20 0.30

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
SCHEMBL27883560 0.74
SCHEMBL8559331 0.72 NISCH (0.38) NISCHMTORADKALDH1A1KDM4E
SCHEMBL4273595 0.71 NISCH (0.34) NISCHMTORADKALDH1A1KDM4E
SCHEMBL779679 0.71 NISCH (0.43) NISCHMTORADKALDH1A1MEN1
SCHEMBL13386056 0.68 NISCH (0.37) NISCHMTORADKALDH1A1KDM4E
SCHEMBL4642439 0.67 CYP11B2 (0.39) MEN1KMT2A
SCHEMBL14969027 0.67 NISCH (0.37) NISCHMTORADKALDH1A1BRD4
SCHEMBL81650 0.67 NISCH (0.59) NISCHMTORADKALDH1A1KDM4E
SCHEMBL1205638 0.66
SCHEMBL6844699 0.65 F2RL1 (0.49) NISCHMTORADKALDH1A1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6803367-B2 ANTICANCER AGENTS; SYNERGISTIC MIXTURES TAKARA SHUZO CO., LTD. (JP) 2004-10-12 US disclosed
CN-1125023-C Apoptosis inducer TAKARA SHUZO CO (JP) 2003-10-22 CN disclosed
US-20030065014-A1 Substance for inducing apoptosis TAKARA BIO INC. (JP) 2003-04-03 US disclosed
US-6525082-B1 2-hydroxy-4-(1-imidazolyl)-2-cyclopenten-1-one; inhibiting growth of cancer cells TAKARA SHUZO CO., LTD. (JP) 2003-02-25 US disclosed
CN-1281426-A Substance inducing apoptosis TAKARA SHUZO CO (JP) 2001-01-24 CN disclosed
EP-1048641-A1 APOPTOSIS INDUCER Takara Shuzo Co, Ltd. (JP) 2000-11-02 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-20030065014-A1 Substance for inducing apoptosis BAX, BCL2, BAD NISCH 3050/4885MTOR 813/4885ADK 3382/4885

“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.