Methane

Methane

SCHEMBL28329643

C.Nc1ccc(-c2nc(-c3ccc(N)cc3)nc(-c3ccc(N)cc3)n2)cc1

nearest known ligand 0.60

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
ALDH1A1 P00352 5/20 0.60
MAPT P10636 4/20 0.60
HPGD P15428 3/20 0.60
CYP3A4 P08684 3/20 0.59
TP53 P04637 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
NPC1 O15118 6/20 0.56
RAB9A P51151 6/20 0.56
KDM4E B2RXH2 3/20 0.56
HSD17B10 Q99714 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
CYP19A1 P11511 1/20 0.54
LMNA P02545 3/20 0.50
ATM Q13315 1/20 0.50
GLA P06280 1/20 0.50
PIK3R1 P27986 1/20 0.48
PIK3CA P42336 1/20 0.48
MTOR P42345 1/20 0.48

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
SCHEMBL8425035 0.97 MEN1 (0.62) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL31633459 0.94 ALDH1A1 (0.69) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3420215 0.86 RAB9A (0.67) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL11585315 0.86 MEN1 (0.79) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12176998 0.86 MEN1 (0.79) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL6982316 0.84 RAB9A (0.64) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16614072 0.84 MEN1 (0.76) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19417162 0.84 MEN1 (0.76) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL29500282 0.84 MEN1 (0.83) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL11779192 0.84 L3MBTL1 (0.62) MEN1KMT2AALDH1A1MAPTHPGD

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-110483797-A The method of carbon material surface in-situ preparation polyimide type covalent organic frame material NANJING UNIVERSITY OF TECHNOLOGY 2019-11-22 CN claimed
CN-110483797-A The method of carbon material surface in-situ preparation polyimide type covalent organic frame material NANJING UNIVERSITY OF TECHNOLOGY 2019-11-22 CN disclosed