SCHEMBL30600557

SCHEMBL30600557

CCOC(c1ncccc1Br)c1ncccc1Br.[Ru+2]

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HPGD P15428 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
GRM5 P41594 1/20 0.30
GRM4 Q14833 1/20 0.30
FFAR1 O14842 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL30600555 0.98 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL22953400 0.84 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL29626881 0.84 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL2627815 0.73 TRPM8 (0.40) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL31068984 0.73 TRPM8 (0.40) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL1332464 0.71 TRPM8 (0.33) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL31042936 0.71 TSHR (0.47) ALDH1A1SMN1; SMN2LMNAHPGDTRPM8
SCHEMBL28198168 0.71 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL23295405 0.69 TRPM8 (0.36) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL23295409 0.69 TRPM8 (0.36) ALDH1A1SMN1; SMN2LMNANPC1RAB9A

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-113861387-B Ionic cycloolefin polymer, photo-self-repairing material based on ionic cycloolefin polymer, preparation method and application thereof 天津大学 2023-08-01 CN disclosed