SCHEMBL6759945

SCHEMBL6759945

O=C(O)CC/C=C/CCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.68
GPR52 Q9Y2T5 5/20 0.58
MMP12 P39900 5/20 0.56
FFAR4 Q5NUL3 1/20 0.53
LMNA P02545 2/20 0.52
ABCC4 O15439 1/20 0.52
GAA P10253 1/20 0.52
TSHR P16473 1/20 0.52
PTGS1 P23219 1/20 0.52
HTT P42858 1/20 0.52
MMP13 P45452 4/20 0.50
KEAP1 Q14145 1/20 0.50
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP14 P50281 1/20 0.49
HDAC2 Q92769 1/20 0.47
CYP1A2 P05177 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 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
SCHEMBL6759953 1.00 FFAR1 (0.68) FFAR1GPR52MMP12FFAR4LMNA
SCHEMBL7738555 0.89 KEAP1 (0.63) FFAR1GPR52KEAP1HDAC2SMN1; SMN2
SCHEMBL6758432 0.89 KEAP1 (0.63) FFAR1GPR52KEAP1HDAC2SMN1; SMN2
SCHEMBL7738550 0.89 KEAP1 (0.63) FFAR1GPR52KEAP1HDAC2SMN1; SMN2
SCHEMBL6759998 0.89 KEAP1 (0.63) FFAR1GPR52KEAP1HDAC2SMN1; SMN2
SCHEMBL6758436 0.89 KEAP1 (0.63) FFAR1GPR52KEAP1HDAC2SMN1; SMN2
SCHEMBL6756569 0.82 CA2 (0.48) FFAR1GPR52KEAP1
SCHEMBL6756571 0.82 CA2 (0.48) FFAR1GPR52KEAP1
SCHEMBL1211561 0.81 FFAR1 (1.00) FFAR1MMP12FFAR4LMNAABCC4
SCHEMBL8618654 0.81 FFAR1 (1.00) FFAR1MMP12FFAR4LMNAABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040034097-A1 Pesticidal activity of functionalized alkenes LINDERMAN RUSSELL J (US) 2004-02-19 US claimed
US-20020193436-A1 Pesticidal activity of functionalized alkenes NORTH CAROLINA STATE UNIVERSITY 2002-12-19 US claimed
WO-2002098220-A2 PESTICIDAL ACTIVITY OF FUNCTIONALIZED ALKENES NORTH CAROLINA STATE UNIVERSITY (US) 2002-12-12 WO claimed
US-6720450-B2 USING SUCH AS 7-CYCLOHEXYL-(4,5-METHANO)HEPTANOIC ACID; CONTROLLING BLOOD INGESTING INSECTS NORTH CAROLINA STATE UNIVERSITY 2004-04-13 US disclosed
US-20040034097-A1 Pesticidal activity of functionalized alkenes LINDERMAN RUSSELL J (US) 2004-02-19 US disclosed
US-6660770-B2 Inhibit digestion by terminating or blocking synthesis of digestive enzymes by activating trypsin modulating oostatic factor receptor NORTH CAROLINA STATE UNIVERSITY 2003-12-09 US disclosed
US-20030149103-A1 Pesticidal activity of functionalized cyclopropanes NORTH CAROLINA STATE UNIVERSITY 2003-08-07 US disclosed
WO-2003051118-A1 PESTICIDAL ACTIVITY OF FUNCTIONALIZED CYCLOPROPANES NORTH CAROLINA STATE UNIVERSITY (US) 2003-06-26 WO disclosed
US-20020193436-A1 Pesticidal activity of functionalized alkenes NORTH CAROLINA STATE UNIVERSITY 2002-12-19 US disclosed
WO-2002098220-A2 PESTICIDAL ACTIVITY OF FUNCTIONALIZED ALKENES NORTH CAROLINA STATE UNIVERSITY (US) 2002-12-12 WO 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 (3 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-20020193436-A1 Pesticidal activity of functionalized alkenes VIP, ANPEP, APEH FFAR1 369/4885GPR52 780/4885MMP12 1180/4885
US-20040034097-A1 Pesticidal activity of functionalized alkenes VIP, ANPEP, APEH FFAR1 369/4885GPR52 780/4885MMP12 1180/4885
US-20030149103-A1 Pesticidal activity of functionalized cyclopropanes DDT, PPIF, CYP4F3 FFAR1 3118/4885GPR52 2429/4885MMP12 1033/4885

“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.