Methane

Methane

SCHEMBL8775730

C.FC(F)(F)c1ccccn1

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
AHR P35869 1/20 0.46
TRPV4 Q9HBA0 1/20 0.43
KDM4E B2RXH2 2/20 0.42
CYP1A2 P05177 2/20 0.42
BLM P54132 2/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
CCR1 P32246 1/20 0.42
CCR5 P51681 1/20 0.42
CCR8 P51685 1/20 0.42
METAP1 P53582 1/20 0.42
HIF1A Q16665 1/20 0.42
DOHH Q9BU89 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
GAA P10253 1/20 0.41
MDM2 Q00987 1/20 0.41
LOXL2 Q9Y4K0 2/20 0.41
GABRA1 P14867 1/20 0.40

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
SCHEMBL5041519 0.97 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL29401687 0.97 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL29424134 0.97 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL84051 0.97 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
Bromide SCHEMBL22440321 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL28480196 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
Hydrochloric Acid SCHEMBL18039122 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
Hydrochloric Acid SCHEMBL30785438 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL27951465 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E
SCHEMBL28002956 0.95 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1AHRTRPV4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0806455-A2 Methine and azamethine dyes derived from trifluoromethylpyridones BASF AKTIENGESELLSCHAFT (DE) 1997-11-12 EP disclosed