SCHEMBL28841440

SCHEMBL28841440

CN1C=CN(CC(=O)c2cccc3ccccc23)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ HPGD P15428 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ GMNN O75496 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ BLM P54132 2/20 0.47
▸ PMP22 Q01453 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ CMKLR1 Q99788 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47

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
SCHEMBL29794018 0.81 ERCC5 (0.44) KMT2AHTT
SCHEMBL28841331 0.81 KMT2A (0.55) ALDH1A1PTPN1MEN1KMT2ATP53
Naphthoic Acid SCHEMBL28147039 0.81 NR4A1 (0.51) NR4A1NR4A2NR4A3CNR2CNR1
Bromide SCHEMBL10529228 0.80 ERCC5 (0.43) KMT2AHTT
SCHEMBL28841411 0.78 NPC1 (0.48) ALDH1A1SMN1; SMN2MEN1LMNAPOLB
Bromide SCHEMBL27280124 0.77 KMT2A (0.36) ALDH1A1MAPTSMN1; SMN2KMT2A
Bromide SCHEMBL10528574 0.77 NPC1 (0.47) ALDH1A1SMN1; SMN2MEN1LMNAPOLB
SCHEMBL28841390 0.76 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ESMN1; SMN2PTPN1
Hydrochloric Acid SCHEMBL10526726 0.75 KMT2A (0.43) ALDH1A1MAPTKDM4ESMN1; SMN2HPGD
Bromide SCHEMBL3845509 0.75 NPC1 (0.46) ALDH1A1MAPTKDM4ESMN1; SMN2PTPN1

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-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN claimed
CN-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN disclosed
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