SCHEMBL7196874

SCHEMBL7196874

CCC1=C(C(=O)OC)C(c2ccc(F)c(I)c2)C2=C(COCC2=O)N1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 19/20 0.59
KCNJ11 Q14654 19/20 0.59
ABCC8 Q09428 6/20 0.48
KCNJ8 Q15842 6/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 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
SCHEMBL7148558 0.89 ABCC9 (0.64) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7149534 0.88 ABCC9 (0.57) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL5075084 0.81 ABCC9 (0.64) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL5073099 0.80 ABCC9 (0.73) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7149169 0.78 KDM4E (0.48) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL5075485 0.76 ABCC9 (0.68) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7145540 0.74 ABCC9 (0.61) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7148311 0.74 ABCC9 (0.76) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7147032 0.74 ABCC9 (0.76) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7153511 0.74 ABCC9 (0.76) ABCC9KCNJ11ABCC8KCNJ8

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
US-6632418-B2 Therapy for asthma, sexual disorders, hypotensive agents, analgesics ABBOTT LABORATORIES 2003-10-14 US disclosed
US-20030065182-A1 Novel radioligands and their use for identifying potassium channel modulators ABBOTT LABORATORIES 2003-04-03 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 (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-20030065182-A1 Novel radioligands and their use for identifying potassium channel modulators KCNN3, KCNN1, KCNN2 ABCC9 512/4885KCNJ11 47/4885ABCC8 485/4885

“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.