SCHEMBL4568630

SCHEMBL4568630

COc1cc2c(O)cc3c(c2cc1CS)-c1ccccc1C31CC(C)(C)CC(C)(C)C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.31
PDK2 Q15119 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL24404156 0.89 PDK2 (0.35) PARP1PDK2MEN1KMT2A
SCHEMBL4568682 0.88
SCHEMBL4568677 0.86
SCHEMBL4568640 0.86
SCHEMBL25954033 0.85 PARP1 (0.33) PARP1PDK2
SCHEMBL4568638 0.85 PDK2 (0.34) PARP1PDK2MEN1KMT2A
SCHEMBL12424702 0.85 PARP1 (0.35) PARP1PDK2MEN1KMT2A
SCHEMBL4568629 0.84
SCHEMBL4568642 0.84
SCHEMBL10292844 0.83 AVPR1A (0.34) PARP1PDK2MEN1KMT2A

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-8308996-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2012-11-13 US disclosed
US-20120121934-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-05-17 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-20120121934-A1 CHROMENE COMPOUND TST, CNOT1, CNOT9 PARP1 2853/4885PDK2 2443/4885MEN1 3409/4885

“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.