SCHEMBL27913097

SCHEMBL27913097

CCCCCCCCOc1ccccc1N(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
CHRM2 P08172 1/20 0.49
CYP3A4 P08684 1/20 0.49
ADRA2A P08913 1/20 0.49
MAPT P10636 1/20 0.49
OPRK1 P41145 1/20 0.49
HTR2B P41595 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TLR8 Q9NR97 2/20 0.46
LTA4H P09960 1/20 0.45
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL27490636 1.00 MEN1 (0.49) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL27910856 1.00 MEN1 (0.49) MEN1KMT2ANR1I2LMNACHRM2
Boric Acid SCHEMBL28174262 0.94 MEN1 (0.48) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL28807470 0.93 CYP1A2 (0.53) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL27897634 0.85 MEN1 (0.43) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL11447881 0.84 LMNA (0.44) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL10490480 0.83 MEN1 (0.51) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL27523908 0.82 MEN1 (0.46) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL9879637 0.81 ALDH1A1 (0.43) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL7893720 0.80 ALDH1A1 (0.48) MEN1KMT2ALMNAMAPTCYP1A2

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
CN-103534290-A Amine-containing difluoro benzotriazolyl polymer and preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2014-01-22 CN disclosed
CN-103012163-A Double-fluoranthene organic semiconductor material as well as preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-04-03 CN disclosed