SCHEMBL28656982

SCHEMBL28656982

O=C(Nc1ccc(NC(=O)C2CCCC2)cc1)C1CCCCC1

nearest known ligand 0.89

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.89
▸ HPGD P15428 1/20 0.81
▸ LMNA P02545 3/20 0.68
▸ MAPT P10636 1/20 0.68
▸ SMN1; SMN2 Q16637 1/20 0.68
▸ NPSR1 Q6W5P4 1/20 0.68
▸ RAB9A P51151 1/20 0.67
▸ ENPP3 O14638 2/20 0.66
▸ ENPP1 P22413 2/20 0.66
▸ ALDH1A1 P00352 1/20 0.66
▸ STS P08842 1/20 0.66
▸ PTPN2 P17706 1/20 0.66
▸ NAMPT P43490 1/20 0.66
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ NPC1 O15118 1/20 0.63
▸ ENPP2 Q13822 1/20 0.62

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
SCHEMBL125695 1.00 PTPN1 (0.89) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9851155 0.92 PTPN1 (0.77) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL29057710 0.92 PTPN1 (0.77) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL95889 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL1785803 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL8296637 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL8363734 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTNPSR1
SCHEMBL29605135 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL678484 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2
SCHEMBL30799036 0.91 PTPN1 (0.74) PTPN1HPGDLMNAMAPTSMN1; SMN2

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-113621175-B Efficient isotactic polypropylene beta-crystal form nucleating agent and preparation method and application thereof 中国科学院化学研究所 2022-10-18 — — CN disclosed
CN-113621175-A Efficient isotactic polypropylene beta-crystal form nucleating agent and preparation method and application thereof 中国科学院化学研究所 2021-11-09 — — CN disclosed
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