SCHEMBL13338293

SCHEMBL13338293

CNCCCC(NC(C)C)C(C)=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 3/20 0.53
▸ HTR2A P28223 1/20 0.32
▸ HRH1 P35367 1/20 0.32

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
SCHEMBL24157441 0.94 KISS1R (0.47) KISS1R
SCHEMBL16692059 0.87 KISS1R (0.43) KISS1RHTR2AHRH1
SCHEMBL16248522 0.87 KISS1R (0.43) KISS1RHTR2AHRH1
SCHEMBL13366903 0.82 KISS1R (0.53) KISS1RHTR2AHRH1
SCHEMBL12890790 0.82 KISS1R (0.53) KISS1RHTR2AHRH1
SCHEMBL14525182 0.82 KISS1R (0.53) KISS1RHTR2AHRH1
SCHEMBL16692066 0.81 KISS1R (0.39) KISS1R
SCHEMBL21297374 0.81 KISS1R (0.39) KISS1R
SCHEMBL27309897 0.81 KISS1R (0.39) KISS1R
SCHEMBL21152967 0.80 C3AR1 (0.36) KISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100129800-A1 POLYMERS AND THEIR USE AS FLUORESCENT LABELS AYMAMI BOFARULL JUAN 2010-05-27 — — US disclosed
WO-2009007397-A1 NEW POLYMERS AND THEIR USE AS FLUORESCENT LABELS CRYSTAX PHARMACEUTICALS, S.L. (ES) 2009-01-15 — — WO disclosed
EP-2014698-A1 Polymers and their use as fluorescent labels Crystax Pharmaceuticals S.L. (ES) 2009-01-14 — — EP 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-20100129800-A1 POLYMERS AND THEIR USE AS FLUORESCENT LABELS CBR3, H1-0, H1-3 KISS1R 996/4885HTR2A 2806/4885HRH1 34/4885

“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.

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