SCHEMBL28954486

SCHEMBL28954486

Cc1ccc(C(=O)n2cccc2C=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.43
▸ BCHE P06276 1/20 0.43
▸ F2 P00734 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ TRIM24 O15164 1/20 0.43
▸ TRIM33 Q9UPN9 1/20 0.43
▸ HTT P42858 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ PKM P14618 4/20 0.42
▸ HPGD P15428 4/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ ATM Q13315 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ NLRP1 Q9C000 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL28954485 0.78 BCHE (0.48) BCHEALDH1A1HPGDSMN1; SMN2TDP1
SCHEMBL21407436 0.74 TRIM24 (0.52) KMT2ACYP1A2TRIM24TRIM33ALDH1A1
SCHEMBL28954484 0.73 PLA2G7 (0.49) KMT2ACYP1A2HTTLMNAALDH1A1
SCHEMBL30267476 0.73 PLA2G7 (0.49) KMT2ACYP1A2HTTLMNAALDH1A1
SCHEMBL22076913 0.72 ATM (0.48) CYP1A2TRIM24TRIM33ALDH1A1SMN1; SMN2
SCHEMBL8377839 0.71 ALDH1A1 (0.45) KMT2ABCHECYP1A2TRIM24TRIM33
SCHEMBL25304831 0.71 PTGS1 (0.49) KMT2ABCHEF2CYP1A2HTT
SCHEMBL29190993 0.71 KMT2A (0.53) KMT2ABCHEF2CYP1A2HTT
SCHEMBL28885007 0.71 TRIM24 (0.47) BCHECYP1A2TRIM24TRIM33LMNA
Hydrochloric Acid SCHEMBL25306621 0.70 PTGS1 (0.48) KMT2ABCHEF2CYP1A2HTT

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-111943935-B Prolinol rapid desulfurizing agent and preparation method thereof 西安工业大学 2023-02-10 — — CN disclosed
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