SCHEMBL9066792

SCHEMBL9066792

CC(C)Nc1cccc2cccc(N(C)C)c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.59
GAA P10253 4/20 0.59
MAPT P10636 4/20 0.59
MCL1 Q07820 1/20 0.35
KDM1A O60341 1/20 0.35
ALDH1A1 P00352 5/20 0.34
TSHR P16473 2/20 0.33
NR4A2 P43354 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 2/20 0.33
KCNH3 Q9ULD8 1/20 0.33
IDO1 P14902 1/20 0.33
NSD2 O96028 1/20 0.33
EGFR P00533 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KCNQ2 O43526 1/20 0.32
CXCR2 P25025 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR2A P28223 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
SCHEMBL6533012 0.82 TDP1 (0.41) KDM4EGAAMAPTALDH1A1TSHR
SCHEMBL9066850 0.79 MAPT (0.65) KDM4EGAAMAPTMCL1KDM1A
SCHEMBL26575221 0.79 KDM1A (0.43) KDM4EGAAMAPTKDM1AALDH1A1
SCHEMBL29363940 0.76 MAPT (1.00) KDM4EGAAMAPTMCL1ALDH1A1
SCHEMBL28279 0.76 MAPT (1.00) KDM4EGAAMAPTMCL1ALDH1A1
SCHEMBL6285846 0.76 MAPT (1.00) KDM4EGAAMAPTMCL1ALDH1A1
SCHEMBL15040636 0.74 ALDH1A1 (0.46) KDM4EGAAMAPTALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL6838810 0.74 MAPT (0.95) KDM4EGAAMAPTMCL1ALDH1A1
SCHEMBL30833304 0.74 MAPT (0.95) KDM4EGAAMAPTMCL1ALDH1A1
Hydrochloric Acid SCHEMBL9815129 0.74 MAPT (0.95) KDM4EGAAMAPTMCL1ALDH1A1

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-0326223-B1 Copolymer composition SHELL INT RESEARCH (NL) 1996-05-08 EP disclosed
EP-0326223-A2 Copolymer composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-08-02 EP disclosed