SCHEMBL9829670

SCHEMBL9829670

COc1cc(OC)c(OC)cc1CN1CCCC1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.66
TDP1 Q9NUW8 2/20 0.61
LMNA P02545 1/20 0.60
HTT P42858 1/20 0.60
POLB P06746 1/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
KMT2A Q03164 1/20 0.56
GAA P10253 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL3379887 0.86 GAA (0.55) KDM4ETDP1MEN1ALDH1A1TSHR
SCHEMBL25854573 0.84 KDM4E (0.60) KDM4ETDP1LMNAPOLBMEN1
Hydrochloric Acid SCHEMBL27837634 0.82 KDM4E (0.63) KDM4ETDP1LMNAHTTPOLB
SCHEMBL6604508 0.81 KDM4E (0.80) KDM4ETDP1MEN1ALDH1A1TSHR
SCHEMBL1427564 0.80 KDM4E (0.83) KDM4ETDP1MEN1ALDH1A1TSHR
SCHEMBL9831262 0.79 KDM4E (0.64) KDM4ETDP1LMNAPOLBMEN1
SCHEMBL2760407 0.79 MEN1 (0.62) KDM4ETDP1POLBMEN1ALDH1A1
SCHEMBL9830022 0.79 KDM4E (0.68) KDM4ETDP1POLBMEN1ALDH1A1
SCHEMBL12879726 0.79 KDM4E (0.68) KDM4ETDP1POLBMEN1ALDH1A1
SCHEMBL24746190 0.79 KDM4E (0.55) KDM4ETDP1MEN1ALDH1A1TSHR

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
EP-0449989-A1 6,7 DIHYDROPYRROLO 3,4-c] PYRIDO 2,3-d] PYRIMIDINE DERIVATIVES Sloan-Kettering Institute For Cancer Research (US) 1991-10-09 EP claimed
WO-1990007496-A1 6,7 DIHYDROPYRROLO[3,4-c] PYRIDO[2,3-d] PYRIMIDINE DERIVATIVES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-07-12 WO claimed