SCHEMBL4385645

SCHEMBL4385645

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2ccccc2)c1CC=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.41
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CDK4 P11802 1/20 0.39
CCNB1 P14635 1/20 0.39
CCND1 P24385 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ERN1 O75460 3/20 0.37
GAA P10253 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
NPC1 O15118 2/20 0.36

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
SCHEMBL4385840 0.91 MAPT (0.39) MAPK14MAPTL3MBTL1MAPK1TDP1
SCHEMBL4390358 0.85 EGFR (0.38) MAPTKDM4E
SCHEMBL4389605 0.83 HPGD (0.39) MAPK14MAPTKDM4ELMNANPC1
SCHEMBL4383171 0.82 PTGER1 (0.48) MAPK14NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4382835 0.81 CYP4F2 (0.43) MAPK14CDK1CCNB1MAPTL3MBTL1
SCHEMBL4380278 0.79 HPGD (0.42) MAPK14KDM4ELMNANPC1RAB9A
SCHEMBL4384794 0.77 PLA2G2A (0.41) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL4384766 0.76 HMGCR (0.41) MAPK14CDK1CCNB1MAPTL3MBTL1
SCHEMBL4379037 0.75 MAOB (0.43) MAPK14CCNB2CDK1CDK4CCNB1
SCHEMBL4384038 0.74 MAPK14 (0.35) MAPK14CDK1CCNB1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P MAPK14 1693/4885CCNB2 2449/4885CDK1 1368/4885

“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.