SCHEMBL28997722

SCHEMBL28997722

C[CH]CC(C)NCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 6/20 0.63
▸ POLB P06746 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ BCHE P06276 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ MAPK1 P28482 1/20 0.42
▸ TAAR1 Q96RJ0 3/20 0.42
▸ SLC18A2 Q05940 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL13675822 0.83 SIGMAR1 (0.61) SIGMAR1POLBSMN1; SMN2BCHELMNA
SCHEMBL10696254 0.83 SIGMAR1 (0.61) SIGMAR1POLBSMN1; SMN2BCHELMNA
SCHEMBL9063684 0.83 SIGMAR1 (0.61) SIGMAR1POLBSMN1; SMN2BCHELMNA
SCHEMBL27813235 0.83 SIGMAR1 (0.61) SIGMAR1POLBSMN1; SMN2BCHELMNA
SCHEMBL9878514 0.79 SIGMAR1 (0.56) SIGMAR1POLBSMN1; SMN2BCHEMAPK1
N-Benzylamphetamine SCHEMBL2795222 0.78 SIGMAR1 (1.00) SIGMAR1POLBLMNAMAPK1TAAR1
SCHEMBL172633 0.78 SIGMAR1 (0.70) SIGMAR1POLBSMN1; SMN2BCHELMNA
N-Benzylamphetamine SCHEMBL2451256 0.78 SIGMAR1 (1.00) SIGMAR1POLBLMNAMAPK1TAAR1
SCHEMBL13675825 0.78 SIGMAR1 (0.70) SIGMAR1POLBSMN1; SMN2BCHELMNA
N-Benzylamphetamine SCHEMBL2798189 0.78 SIGMAR1 (1.00) SIGMAR1POLBLMNAMAPK1TAAR1

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-112759673-B Catalyst for olefin polymerization, catalyst component and application thereof 中国石油化工股份有限公司 2023-02-28 — — CN disclosed
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