SCHEMBL9979696

SCHEMBL9979696

CCOC(=O)C(O)CCCCCCl

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
CPB2 Q96IY4 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HIF1A Q16665 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.34

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
SCHEMBL27842102 0.98 SMN1; SMN2 (0.40) GPR84FFAR1CPB2SMN1; SMN2KMT2A
SCHEMBL9773213 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL7522764 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL7515147 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL1683717 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL6049889 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL7519047 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL509990 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL2877290 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7
SCHEMBL5812678 0.84 GPR84 (0.61) GPR84FFAR1MAPTZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117430849-B Long side chain polyaromatic alkane anion exchange membrane and preparation method thereof 大连理工大学 2024-02-23 CN disclosed
CN-117430849-A Long side chain polyaromatic alkane anion exchange membrane and preparation method thereof 大连理工大学 2024-01-23 CN disclosed
EP-2394979-B1 INTERMEDIATE OF CILASTATIN AND PREPARATION METHOD THEREOF ZHEJIANG HISOAR PHARMACEUTICAL CO LTD (CN) 2014-11-05 EP disclosed
US-8822716-B2 Intermediate of cilastatin and preparation method thereof ZHEJIANG HISOAR PHARMACEUTICAL CO., LTD (CN) 2014-09-02 US disclosed
US-20110319653-A1 Intermediate of Cilastatin and Preparation Method Thereof ZHEJIANG HISOAR PHARMACEUTICAL CO., LTD (CN) 2011-12-29 US disclosed
EP-2394979-A1 INTERMEDIATE OF CILASTATIN AND PREPARATION METHOD THEREOF Zhejiang Hisun Pharmaceutical Co. Ltd. (CN) 2011-12-14 EP disclosed
CN-101265187-B Method for preparing ethyl 7-chloro-2-oxyheptanoate TAICANG PUYUAN CHEMICAL CO LTD 2011-09-21 CN disclosed
CN-101265187-A Method for preparing ethyl 7-chloro-2-oxyheptanoate TAICANG PUYUAN CHEMICAL CO LTD (CN) 2008-09-17 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110319653-A1 Intermediate of Cilastatin and Preparation Method Thereof CYP8B1, DHCR7, HMGCR GPR84 3826/4885FFAR1 1611/4885CPB2 293/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.