SCHEMBL13868673

SCHEMBL13868673

CC1(C)CC(C)(C)CC2(C1)c1ccccc1-c1c2cc(O)c2ccc(-c3ccc(N4CCOCC4)cc3)cc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
PDK2 Q15119 2/20 0.39
FYN P06241 2/20 0.36
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 2/20 0.34
AHR P35869 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR2 P34972 1/20 0.34
NPC1 O15118 2/20 0.34
LMNA P02545 2/20 0.34
RAB9A P51151 2/20 0.34
HCRTR1 O43613 1/20 0.34
GAA P10253 1/20 0.34
LRRK2 Q5S007 1/20 0.34
JAK2 O60674 1/20 0.34

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
SCHEMBL24605103 0.93 PDK2 (0.43) HSD17B1HSD17B2PDK2KDM4EALDH1A1
SCHEMBL10262943 0.90 PDK2 (0.39) HSD17B1HSD17B2PDK2FYNKDM4E
SCHEMBL10262978 0.88 PDK2 (0.37) HSD17B1HSD17B2PDK2FYNKDM4E
SCHEMBL10267942 0.88 PDK2 (0.37) HSD17B1HSD17B2PDK2FYNKDM4E
SCHEMBL15449572 0.88 PDK2 (0.37) HSD17B1HSD17B2PDK2FYNKDM4E
SCHEMBL10262645 0.86 CFTR (0.36) HSD17B1HSD17B2PDK2KDM4EALDH1A1
SCHEMBL13868678 0.86 FYN (0.40) PDK2FYNKDM4EALDH1A1MAPT
SCHEMBL10261936 0.86 PDK2 (0.37) HSD17B1HSD17B2PDK2KDM4EALDH1A1
SCHEMBL10293036 0.86 FYN (0.40) PDK2FYNKDM4EALDH1A1MAPT
SCHEMBL15452240 0.86 PDK2 (0.35) HSD17B1HSD17B2PDK2FYNKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521004-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2009-04-21 US disclosed
US-7521004-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2009-04-21 US disclosed
US-20070215844-A1 Chromene Compound TOKUYAMA CORPORATION (JP) 2007-09-20 US disclosed
US-20070215844-A1 Chromene Compound TOKUYAMA CORPORATION (JP) 2007-09-20 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-20070215844-A1 Chromene Compound CRY2, TYR, CRY1 HSD17B1 1472/4885HSD17B2 1560/4885PDK2 893/4885

“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.