SCHEMBL29636274

SCHEMBL29636274

Cc1nc(N)c(N)cc1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
PTK2 Q05397 1/20 0.37
TERT O14746 1/20 0.36
NQO1 P15559 1/20 0.35
NOS3 P29474 3/20 0.33
NOS1 P29475 3/20 0.33
NOS2 P35228 3/20 0.33
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 3/20 0.32
ALOX15 P16050 2/20 0.32
UHRF1 Q96T88 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
CYP1A2 P05177 1/20 0.32
CASP7 P55210 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL11715917 1.00 LMNA (0.39) LMNAPTK2TERTNQO1NOS3
Hydrochloric Acid SCHEMBL9129365 0.97 LMNA (0.37) LMNAPTK2TERTNQO1NOS3
SCHEMBL94535 0.85 PTK2 (0.44) LMNAPTK2TERTNQO1NOS3
SCHEMBL27454384 0.81 CYP3A4 (0.43) LMNATERTNQO1NOS3NOS1
SCHEMBL20280105 0.81 CYP3A4 (0.43) LMNATERTNQO1NOS3NOS1
Hydrochloric Acid SCHEMBL27496477 0.79 CYP3A4 (0.42) LMNATERTNQO1NOS3NOS1
SCHEMBL296626 0.78 PTK2 (0.50) PTK2TERTNQO1ALDH1A1KDM4E
SCHEMBL16666040 0.77 LMNA (0.44) LMNATERTNQO1NOS3NOS1
SCHEMBL8478664 0.77 CD44 (0.46) LMNACYP3A4ALDH1A1KDM4EGAA
SCHEMBL21556800 0.77 LMNA (0.39) LMNATERTNQO1NOS3NOS1

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
CN-114409861-A Low-dielectric ablation-resistant benzoxazine resin and preparation method thereof 北京玻钢院复合材料有限公司 2022-04-29 CN disclosed