SCHEMBL28435751

SCHEMBL28435751

CNCCCCCCCCCCCCCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 1.00
L3MBTL1 Q9Y468 1/20 0.96
MEN1 O00255 1/20 0.80
KMT2A Q03164 1/20 0.80
ATM Q13315 1/20 0.68
TAAR1 Q96RJ0 1/20 0.68
S1PR2 O95136 1/20 0.59
S1PR4 O95977 1/20 0.59
S1PR1 P21453 1/20 0.59
S1PR3 Q99500 1/20 0.59

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
SCHEMBL15766433 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL5911099 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL19391367 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL920070 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL5988736 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL9149422 1.00 SIGMAR1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL9456850 0.98 SIGMAR1 (0.96) SIGMAR1L3MBTL1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL10483839 0.98 SIGMAR1 (0.96) SIGMAR1L3MBTL1MEN1KMT2AATM
SCHEMBL680531 0.98 L3MBTL1 (1.00) SIGMAR1L3MBTL1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL2997225 0.96 L3MBTL1 (0.96) SIGMAR1L3MBTL1MEN1KMT2AATM

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109022174-B Kitchen heavy oil detergent containing plant essential oil and preparation process thereof 娇时日化(杭州)股份有限公司 2020-07-14 CN claimed
CN-111567927-B Hydrophobic sterilization mask 北京大学深圳研究生院 2022-06-17 CN disclosed
CN-111567927-A Hydrophobic sterilization mask 北京大学深圳研究生院 2020-08-25 CN disclosed
CN-109022174-B Kitchen heavy oil detergent containing plant essential oil and preparation process thereof 娇时日化(杭州)股份有限公司 2020-07-14 CN disclosed
CN-109022174-B Kitchen heavy oil detergent containing plant essential oil and preparation process thereof 娇时日化(杭州)股份有限公司 2020-07-14 CN disclosed