SCHEMBL9404103

SCHEMBL9404103

CCC(OC(=O)Cl)c1c2ccccc2cc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 4/20 0.39
GLA P06280 3/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NR1I2 O75469 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSPO P30536 5/20 0.34
NPSR1 Q6W5P4 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 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
SCHEMBL8372932 0.86 ALDH1A1 (0.40) MEN1KMT2AALDH1A1GLAHPGD
SCHEMBL9404119 0.81 ALDH1A1 (0.39) MEN1KMT2AALDH1A1KDM4EPPARG
SCHEMBL9404141 0.80 ALDH1A1 (0.42) MEN1KMT2AALDH1A1GLAHPGD
SCHEMBL8158169 0.74 KMT2A (0.44) MEN1KMT2AALDH1A1HSD17B10LMNA
SCHEMBL2936559 0.74 KMT2A (0.44) MEN1KMT2AALDH1A1HSD17B10LMNA
SCHEMBL2934528 0.74 KMT2A (0.44) MEN1KMT2AALDH1A1HSD17B10LMNA
SCHEMBL9404136 0.73 L3MBTL1 (0.43) MEN1KMT2AALDH1A1GLAHPGD
SCHEMBL2740643 0.72 KMT2A (0.40) MEN1KMT2AALDH1A1GLAHPGD
SCHEMBL8716442 0.71 GAA (0.39) MEN1KMT2AALDH1A1CYP2C19MAPT
SCHEMBL8763849 0.71 EDNRA (0.48) MEN1KMT2AALDH1A1GLAHPGD

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
EP-0365495-B1 9-Anthrylalkyl compounds, their preparation and their use EKA NOBEL AB (SE) 1994-03-16 EP disclosed
US-5128120-A Use of 9-anthrylalkyl compounds as derivatization reagents for separation and detection purposes EKA NOBEL AB (SE) 1992-07-07 US disclosed
US-5015755-A 9-anthrylalkyl compounds EKA NOBEL AB (SE) 1991-05-14 US disclosed
EP-0365495-A2 9-Anthrylalkyl compounds, their preparation and their use Eka Nobel Aktiebolag (SE) 1990-04-25 EP disclosed