SCHEMBL28880345

SCHEMBL28880345

Cc1c(C#N)cccc1C(C)OC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 2/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
SOS1 Q07889 4/20 0.33
GAA P10253 3/20 0.33
TSHR P16473 2/20 0.33
NOTUM Q6P988 1/20 0.32
AR P10275 1/20 0.32
NLRP3 Q96P20 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
SCHEMBL28880344 1.00 L3MBTL1 (0.35) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL514813 0.86 L3MBTL1 (0.41) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL28880523 0.83 SOS1 (0.35) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL28880525 0.83 SOS1 (0.35) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL28880407 0.80 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL30292599 0.80 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL28880354 0.77 SOS1 (0.34) ALDH1A1LMNASOS1
SCHEMBL28880355 0.77 SOS1 (0.34) ALDH1A1LMNASOS1
SCHEMBL28880383 0.77 HTT (0.35) ALDH1A1LMNA
SCHEMBL28880382 0.77 HTT (0.35) ALDH1A1LMNA

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-117940411-A Quinazoline derivative, or preparation method and application thereof 浙江海正药业股份有限公司 2024-04-26 CN disclosed
CN-116546985-A Pyridopyrimidine derivative and preparation method and application thereof 浙江海正药业股份有限公司 2023-08-04 CN disclosed
CN-115135315-A SOS1 inhibitors 米拉蒂治疗股份有限公司 2022-09-30 CN disclosed