SCHEMBL9928198

SCHEMBL9928198

COc1cc2c(O)cc3c(c2c2c1OCC2)-c1ccccc1C3(C)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.37
PDK2 Q15119 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
MAPT P10636 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
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
SCHEMBL9928149 0.91 PARP1 (0.33) PARP1PDK2MTNR1AMTNR1BMAPT
SCHEMBL9928202 0.90 PARP1 (0.33) PARP1PDK2MTNR1AMTNR1BMAPT
SCHEMBL9928196 0.87 PARP1 (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928204 0.87 CYP1A2 (0.34) PARP1PDK2MTNR1AMTNR1BMAPT
SCHEMBL9928195 0.87 PARP1 (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928153 0.86 MTNR1A (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928197 0.85 PARP1 (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928194 0.85 PARP1 (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928193 0.85 PARP1 (0.32) PARP1MTNR1AMTNR1B
SCHEMBL9928199 0.81 ALOX5AP (0.35)

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-20120145974-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-06-14 US disclosed
US-20120145974-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-06-14 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-20120145974-A1 CHROMENE COMPOUND CRY2, CYP2J2, NR0B2 PARP1 2140/4885PDK2 703/4885MTNR1A 618/4885

“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.