SCHEMBL28067243

SCHEMBL28067243

OB(O)Oc1ccc(Cl)cc1.[NaH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.44
LMNA P02545 1/20 0.40
CYP2A6 P11509 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ORAI1 Q96D31 1/20 0.38
ORAI2 Q96SN7 1/20 0.38
ORAI3 Q9BRQ5 1/20 0.38
TRPV6 Q9H1D0 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL635637 0.97 ENPP2 (0.46) ENPP2LMNACYP2A6MAOAMAOB
Potassium SCHEMBL1305608 0.95 ENPP2 (0.44) ENPP2LMNACYP2A6MAOAMAOB
SCHEMBL27557826 0.95 ENPP2 (0.44) ENPP2LMNACYP2A6MAOAMAOB
Ammonia Solution, Strong SCHEMBL27844793 0.95 ENPP2 (0.44) ENPP2LMNACYP2A6MAOAMAOB
SCHEMBL28085566 0.91 MAOA (0.52) ENPP2MAOAMAOBHPGDMEN1
SCHEMBL28116052 0.91 CYP1A2 (0.42) ENPP2LMNACYP2A6MAOAMAOB
SCHEMBL3800806 0.84 CA1 (0.38) ENPP2MEN1KMT2ACA1CA2
SCHEMBL6398321 0.82 ENPP2 (0.46) ENPP2LMNACYP2A6MAOAMAOB
SCHEMBL31005186 0.78 CYP2A6 (0.46) ENPP2LMNACYP2A6HPGDMEN1
SCHEMBL5377085 0.78 DRD4 (0.43) ENPP2LMNACYP2A6MAOAMAOB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105738435-A Fluorinion polymer film potential type sensor and application thereof 中国科学院烟台海岸带研究所 2016-07-06 CN claimed
CN-105548302-A Detecting method of free radical reaction YANTAI INST COASTAL ZONE RES CAS 2016-05-04 CN claimed
CN-106318386-A Preparation method of boron-chlorine doped carbon quantum dots 常州大学 2017-01-11 CN disclosed
CN-105738435-A Fluorinion polymer film potential type sensor and application thereof 中国科学院烟台海岸带研究所 2016-07-06 CN disclosed
CN-105548302-A Detecting method of free radical reaction YANTAI INST COASTAL ZONE RES CAS 2016-05-04 CN disclosed