SCHEMBL9631019

SCHEMBL9631019

NCCCCC(N)C(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.55
DPP7 Q9UHL4 2/20 0.53
DPP8 Q6V1X1 2/20 0.53
DPP9 Q86TI2 1/20 0.53
MMP2 P08253 2/20 0.51
LTA4H P09960 1/20 0.46
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
ADRA2C P18825 1/20 0.42
F2 P00734 1/20 0.42
MDM2 Q00987 1/20 0.42
MMP9 P14780 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
TERT O14746 2/20 0.41

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
SCHEMBL28992842 1.00 GSR (0.55) GSRDPP7DPP8DPP9MMP2
SCHEMBL16553896 0.98 GSR (0.53) GSRDPP7DPP8DPP9MMP2
SCHEMBL7533307 0.98 GSR (0.53) GSRDPP7DPP8DPP9MMP2
SCHEMBL9630987 0.95 GSR (0.47) GSRDPP7DPP8DPP9MMP2
Pyrophosphoric Acid SCHEMBL29018593 0.89 DPP7 (0.46) GSRDPP7DPP8DPP9MMP2
SCHEMBL2460853 0.87 MDM2 (0.46) TDP1POLBKMT2AMDM2L3MBTL1
SCHEMBL29387120 0.84 AKR1C3 (0.46) GSRDPP7DPP8DPP9MMP2
SCHEMBL10265227 0.84 TDP1 (0.42) DPP7DPP8DPP9MMP2TDP1
SCHEMBL27287213 0.84 CES2 (0.49) MMP2MMP9HTR2AHRH1
SCHEMBL10591572 0.84 POLB (0.51) GSRLTA4HTDP1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116854772-A Analogue of endomorphin and adenine conjugated peptide with analgesic activity and synthesis method thereof 中国人民解放军空军军医大学 2023-10-10 CN claimed
CN-122081289-A Lysyl alkene diol pyrophosphate synthase variant and engineering bacterium for producing sclareol 2026-05-26 CN disclosed
CN-122081291-A Lysyl alkene diol pyrophosphate synthase variant and constructed sclareol synthetic yeast engineering bacteria 2026-05-26 CN disclosed
CN-122081290-A Improved variants of lysyl alkene diol pyrophosphate synthase and yeast engineering bacteria for producing sclareol 2026-05-26 CN disclosed
CN-119859588-A Genetically engineered bacterium, preparation method thereof and application of genetically engineered bacterium in sclareol synthesis 天津凯莱英生物科技有限公司 2025-04-22 CN disclosed
CN-112334581-B Method for biocatalytically producing terpene compounds 弗门尼舍有限公司 2024-11-12 CN disclosed
CN-116854772-A Analogue of endomorphin and adenine conjugated peptide with analgesic activity and synthesis method thereof 中国人民解放军空军军医大学 2023-10-10 CN disclosed
CN-114989997-B Recombinant yarrowia lipolytica for high yield sclareol and construction method and application thereof 南京工业大学 2023-04-28 CN disclosed
EP-0368903-B1 ALTERNATING ALIPHATIC-AROMATIC POLY(ESTERAMIDE) AlliedSignal Inc. (US) 1992-08-26 EP disclosed
EP-0368903-A1 ALTERNATING ALIPHATIC-AROMATIC POLY(ESTERAMIDE). ALLIED SIGNAL INC (US) 1990-05-23 EP disclosed
WO-1989000171-A1 ALTERNATING ALIPHATIC-AROMATIC POLY(ESTERAMIDE) ALLIED-SIGNAL INC. (US) 1989-01-12 WO disclosed
US-4767839-A LIQUID CRYSTAL-FROM A DIACID AND DIESTERDIAMINE ALLIED-SIGNAL INC. (US) 1988-08-30 US disclosed