SCHEMBL28043155

SCHEMBL28043155

CN1C=CN(Cc2ccccc2)C1.FC(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.41
SIGMAR1 Q99720 2/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
OPRM1 P35372 1/20 0.36
KCNH2 Q12809 1/20 0.36
FUCA1 P04066 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
ACHE P22303 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL667066 0.93 MC4R (0.46) MC4RSIGMAR1LMNAPOLBFUCA1
Hydrochloric Acid SCHEMBL383001 0.91 MC4R (0.44) MC4RSIGMAR1KDM4ELMNAPOLB
Iodide SCHEMBL2195243 0.91 MC4R (0.44) MC4RSIGMAR1LMNAPOLBFUCA1
Bromide SCHEMBL1179198 0.91 MC4R (0.44) MC4RSIGMAR1LMNAPOLBFUCA1
SCHEMBL29069617 0.90 MC4R (0.41) MC4RSIGMAR1LMNAPOLBFUCA1
SCHEMBL26646397 0.90 MC4R (0.41) MC4RSIGMAR1LMNAPOLBFUCA1
Bromide SCHEMBL6888623 0.89 MC4R (0.43) MC4RSIGMAR1MEN1KMT2ALMNA
Fluoride SCHEMBL27662151 0.89 MC4R (0.43) MC4RSIGMAR1KDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL29151738 0.89 MC4R (0.43) MC4RSIGMAR1MEN1KMT2ALMNA
Ethylene SCHEMBL28111859 0.89 MC4R (0.43) MC4RSIGMAR1LMNAPOLBFUCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109860392-A A kind of organic solar batteries and preparation method thereof using functionalization graphene quantum dot as electron transfer layer 桂林电子科技大学 2019-06-07 CN disclosed
CN-105633284-B Make trans- organic solar batteries and the preparation of middle layer using Ionic Liquid Films 中国科学院大连化学物理研究所 2018-07-20 CN disclosed
CN-105024014-A Organic solar cell adopting ionic liquid film as interlayer DALIAN CHEMICAL PHYSICS INST 2015-11-04 CN disclosed