SCHEMBL11940342

SCHEMBL11940342

CCCCCCCCCCC[C@@H](C)CC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 10/20 0.64
▸ ACE2 Q9BYF1 1/20 0.62
▸ FFAR1 O14842 3/20 0.52
▸ FFAR4 Q5NUL3 2/20 0.52
▸ PPARD Q03181 6/20 0.50
▸ MAPT P10636 1/20 0.50
▸ LCK P06239 1/20 0.50
▸ ZDHHC20 Q5W0Z9 1/20 0.50
▸ ZDHHC2 Q9UIJ5 1/20 0.50
▸ PPARG P37231 5/20 0.48
▸ PPARA Q07869 5/20 0.48
▸ HDAC11 Q96DB2 4/20 0.48
▸ TSHR P16473 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ TLR2 O60603 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ FABP4 P15090 2/20 0.48
▸ PTPN1 P18031 2/20 0.48
▸ SLC22A6 Q4U2R8 1/20 0.48
▸ SLC22A8 Q8TCC7 1/20 0.48

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
SCHEMBL10386196 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL8049901 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL951973 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL5710467 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL248934 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL1234905 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL23930717 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL3423500 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL22612526 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD
SCHEMBL22612511 1.00 GPR84 (0.64) GPR84ACE2FFAR1FFAR4PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116064442-A Carbonyl reductase and application thereof in catalytic synthesis of (R) -beta-hydroxytetradecanoate methyl ester 国蔷生物科技(南京)有限公司 2023-05-05 — — CN disclosed
US-20180028649-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2018-02-01 — — US disclosed
US-9814772-B2 Synthetic glucopyranosyl lipid adjuvants INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2017-11-14 — — US disclosed
US-20170182155-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS INFECTIOUS DISEASE RES INST (US) 2017-06-29 — — US disclosed
US-20170112924-A1 SYNTHETIC DERIVATIVES OF MPL AND USES THEREOF K2 HEALTHVENTURES LLC, AS CANADIAN COLLATERAL AGENT 2017-04-27 — — US disclosed
US-9480740-B2 Synthetic glucopyranosyl lipid adjuvants INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2016-11-01 — — US disclosed
US-20140356367-A1 MONOPHOSPHORYLATED LIPID A DERIVATIVES WAYNE STATE UNIVERSITY 2014-12-04 — — US disclosed
US-20140328876-A1 SYNTHETIC DERIVATIVES OF MPL AND USES THEREOF VARIATION BIOTECHNOLOGIES INC. (CA) 2014-11-06 — — US disclosed
US-20140322268-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2014-10-30 — — US disclosed
US-8809285-B2 Monophosphorylated lipid A derivatives WAYNE STATE UNIVERSITY (US) 2014-08-19 — — US disclosed
US-20120190633-A1 MONOPHOSPHORYLATED LIPID A DERIVATIVES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-07-26 — — US 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 (7 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-20140356367-A1 MONOPHOSPHORYLATED LIPID A DERIVATIVES SGMS1, PCYT1A, PHOSPHO1 GPR84 1980/4885ACE2 3996/4885FFAR1 379/4885
US-20120190633-A1 MONOPHOSPHORYLATED LIPID A DERIVATIVES SGMS1, PCYT1A, PHOSPHO1 GPR84 1980/4885ACE2 3996/4885FFAR1 379/4885
US-20140322268-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS B3GAT3, GLA, LGALS8 GPR84 1934/4885ACE2 1201/4885FFAR1 925/4885
US-20140328876-A1 SYNTHETIC DERIVATIVES OF MPL AND USES THEREOF MPL, CD47, PLTP GPR84 2777/4885ACE2 1972/4885FFAR1 3573/4885
US-20180028649-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS B3GAT3, GLA, LGALS8 GPR84 2007/4885ACE2 1174/4885FFAR1 958/4885
US-20170112924-A1 SYNTHETIC DERIVATIVES OF MPL AND USES THEREOF MPL, CD47, PLTP GPR84 2876/4885ACE2 1833/4885FFAR1 3587/4885
US-20170182155-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS B3GAT3, GLA, LGALS8 GPR84 1934/4885ACE2 1201/4885FFAR1 925/4885

“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.

Send feedback