SCHEMBL31066751

SCHEMBL31066751

CCOCCN(CCOCC)CCN(CC)CC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 2/20 0.34
CHRM2 P08172 2/20 0.34
CHRM1 P11229 2/20 0.34
DRD3 P35462 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
EBP Q15125 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
KCNH2 Q12809 1/20 0.33
CYP1A2 P05177 1/20 0.32
LTA4H P09960 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 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
SCHEMBL13133175 0.95 MEN1 (0.52) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL830565 0.95 MEN1 (0.56) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL18357965 0.90 MEN1 (0.52) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL12125206 0.89 MEN1 (0.50) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL749829 0.89 ALDH1A1 (0.45) MEN1POLBKMT2AALDH1A1TSHR
SCHEMBL19554732 0.84 MEN1 (0.46) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL9136240 0.83 BLM (0.42) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL1323791 0.83 BLM (0.42) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL135077 0.83 MEN1 (0.61) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL19144434 0.82 MEN1 (0.45) MEN1POLBKMT2AALDH1A1KDM4E

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-118496107-B Organic small molecule inhibitor and application method thereof in thin film deposition 合肥安德科铭半导体科技有限公司 2024-10-29 CN disclosed
CN-118496107-A Organic small molecule inhibitor and application method thereof in thin film deposition 合肥安德科铭半导体科技有限公司 2024-08-16 CN disclosed