SCHEMBL12424673

SCHEMBL12424673

CCCCC1(OC)c2ccccc2-c2ccccc2-c2c1cc(O)c1cc(OC)c(OC)cc21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.35
CNR2 P34972 3/20 0.35
PDK2 Q15119 5/20 0.32
EP300 Q09472 1/20 0.32
PARP1 P09874 1/20 0.31
ELANE P08246 2/20 0.31
CTSG P08311 1/20 0.31
CDK4 P11802 1/20 0.30
CCND1 P24385 1/20 0.30
GSK3B P49841 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
RET P07949 1/20 0.30
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP1B1 Q16678 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
SCHEMBL12424598 0.85 CNR2 (0.35) CNR1CNR2PDK2EP300PARP1
SCHEMBL1531801 0.85 PDK2 (0.36) CNR1CNR2PDK2EP300PARP1
SCHEMBL3920058 0.82 PDK2 (0.36) CNR1CNR2PDK2EP300PARP1
SCHEMBL1963710 0.81 PDK2 (0.37) PDK2EP300PARP1GAAHPGD
SCHEMBL12424633 0.78 ESR1 (0.40) PDK2EP300PARP1GAAHPGD
SCHEMBL28683000 0.77 KCNH2 (0.37) CNR1CNR2PDK2EP300
SCHEMBL12424646 0.76 SCN9A (0.33) HPGD
SCHEMBL26629573 0.75 PDK2 (0.37) CNR1CNR2PDK2EP300PARP1
SCHEMBL12424663 0.74 HSP90AA1 (0.31)
SCHEMBL1531822 0.74 KMT2A (0.41) PDK2EP300PARP1CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7976739-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2011-07-12 US disclosed
US-7976739-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2011-07-12 US disclosed
US-20100230649-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2010-09-16 US disclosed
US-20100230649-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2010-09-16 US disclosed
EP-2055698-A1 CHROMENE COMPOUND Tokuyama Corporation (JP) 2009-05-06 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-20100230649-A1 CHROMENE COMPOUND CCNT1, RB1, H1-0 CNR1 1045/4885CNR2 1581/4885PDK2 1053/4885

“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.