SCHEMBL16301282

SCHEMBL16301282

CC(O)Oc1cc2c3c(cc(O)c2cc1-c1ccc(N2CCOCC2)cc1)C1(CC(C)(C)CC(C)(C)C1)c1ccccc1-3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 6/20 0.35
PDK2 Q15119 2/20 0.33
FYN P06241 2/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CNR2 P34972 1/20 0.31
GSK3B P49841 1/20 0.30
STK10 O94804 1/20 0.30
SLK Q9H2G2 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
SCHEMBL13868678 0.90 FYN (0.40) PDK2FYNALDH1A1KDM4EMAPT
SCHEMBL10293036 0.90 FYN (0.40) PDK2FYNALDH1A1KDM4EMAPT
SCHEMBL10267953 0.89 PDK2 (0.35) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL10262943 0.88 PDK2 (0.39) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL10293147 0.86 PRKDC (0.37) FYNALDH1A1KDM4EMAPTHPGD
SCHEMBL10262267 0.86 CFTR (0.34) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL10262013 0.86 CFTR (0.33) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL10267942 0.86 PDK2 (0.37) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL10262978 0.86 PDK2 (0.37) CFTRPDK2FYNALDH1A1KDM4E
SCHEMBL15449572 0.86 PDK2 (0.37) CFTRPDK2FYNALDH1A1KDM4E

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-8691120-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2014-04-08 US disclosed
US-20120170098-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-07-05 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-20120170098-A1 CHROMENE COMPOUND CRY2, CRY1, SUN2 CFTR 4756/4885PDK2 334/4885FYN 3118/4885

“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.