SCHEMBL14019707

SCHEMBL14019707

C=C(C(=O)Oc1ccccc1)C12CC1CC(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
GAA P10253 2/20 0.37
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 1/20 0.33
ATM Q13315 2/20 0.33
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.32
NR1I2 O75469 1/20 0.32
ABCB11 O95342 1/20 0.32
LMNA P02545 1/20 0.32
P2RX7 Q99572 1/20 0.32
EZH2 Q15910 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
MAPT P10636 1/20 0.31
CCR2 P41597 1/20 0.31

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
SCHEMBL13008544 0.81
SCHEMBL13688370 0.77 ALDH1A1 (0.38) ELANEGAAALDH1A1TSHRKDM4E
SCHEMBL13688377 0.76 RIPK1 (0.39) ELANEGAAKMT2AALDH1A1KDM4E
SCHEMBL13124812 0.75 MEN1 (0.31) KMT2AMEN1
SCHEMBL13688354 0.75 ALDH1A1 (0.43) ELANEGAAALDH1A1KDM4EPOLB
SCHEMBL14019708 0.74 KDM4E (0.33) GAAKDM4EMAPT
SCHEMBL13108991 0.74 SMN1; SMN2 (0.40) GAAKMT2AALDH1A1MEN1MAPT
SCHEMBL14019698 0.71 ADAM17 (0.39) GAAALDH1A1L3MBTL1MAPT
SCHEMBL13688397 0.69 KMT2A (0.38) ELANEGAAKMT2AALDH1A1POLB
SCHEMBL13688369 0.69 KMT2A (0.42) ELANEKMT2AALDH1A1MEN1L3MBTL1

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-20080261118-A1 OPTICAL RECORDING COMPOSITION AND HOLOGRAPHIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-10-23 US disclosed
US-20080261118-A1 OPTICAL RECORDING COMPOSITION AND HOLOGRAPHIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-10-23 US disclosed