SCHEMBL6726642

SCHEMBL6726642

CCCCCCC(=O)NCCOCCOCCCOCCCOCCCOCCCOCCn1cc(COCCOCCOCC[18F])nn1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.43
MMP9 P14780 7/20 0.43
MMP8 P22894 7/20 0.43
MMP13 P45452 7/20 0.43
DGAT1 O75907 7/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
APP P05067 1/20 0.39
F2RL1 P55085 1/20 0.38
GBA1 P04062 1/20 0.38
FOLH1 Q04609 1/20 0.38

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
SCHEMBL13139263 0.86 MMP2 (0.46) MMP2MMP9MMP8MMP13DGAT1
SCHEMBL13139271 0.86 MMP2 (0.46) MMP2MMP9MMP8MMP13DGAT1
SCHEMBL22473656 0.84 ZDHHC20 (0.49) DGAT1ZDHHC20GBA1
SCHEMBL13695965 0.82 DGAT1 (0.45) MMP2MMP9MMP8MMP13DGAT1
SCHEMBL13139260 0.81 MMP2 (0.43) MMP2MMP9MMP8MMP13DGAT1
SCHEMBL13139268 0.81 MMP2 (0.43) MMP2MMP9MMP8MMP13DGAT1
SCHEMBL22083577 0.81 DRD2 (0.44) GBA1FOLH1
SCHEMBL21118389 0.81 DGAT1 (0.47) DGAT1ZDHHC20GBA1
SCHEMBL25978189 0.79 GBA1 (0.48) GBA1
SCHEMBL26032229 0.79 GLP1R (0.39) ZDHHC20CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120121509-A1 VITAL FLUOROCHROME CONJUGATES AND METHODS OF USE THE GENERAL HOSPITAL CORPORATION (US) 2012-05-17 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-20120121509-A1 VITAL FLUOROCHROME CONJUGATES AND METHODS OF USE CASP3, CASP7, CD47 MMP2 3890/4885MMP9 4572/4885MMP8 1940/4885

“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.