SCHEMBL3393327

SCHEMBL3393327

C=CCNn1ccc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.44
CDK4 P11802 4/20 0.41
CCND1 P24385 4/20 0.41
KMT2A Q03164 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 2/20 0.35
NOTUM Q6P988 1/20 0.33
HTR6 P50406 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL2851120 0.79 SLC6A2 (0.45) SLC6A2CDK4CCND1KMT2AHTR2A
SCHEMBL6623448 0.77 SLC6A2 (0.49) SLC6A2CDK4CCND1KMT2AHTR2A
Hydrochloric Acid SCHEMBL6258187 0.76 SLC6A2 (0.47) SLC6A2CDK4CCND1KMT2AHTR2A
SCHEMBL3976417 0.73 SLC6A2 (0.45) SLC6A2CDK4CCND1HTR2AHTR2C
SCHEMBL8349900 0.73 TSHR (0.48) SLC6A2CDK4CCND1KMT2ASLC6A4
SCHEMBL1616727 0.72 CDK4 (0.52) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL3365353 0.72 CDK4 (0.43) SLC6A2CDK4CCND1KMT2AHTR2A
SCHEMBL31045218 0.70 KMT2A (0.53) SLC6A2CDK4CCND1KMT2ANOTUM
SCHEMBL11120771 0.70 KMT2A (0.53) SLC6A2CDK4CCND1KMT2ANOTUM
SCHEMBL3393616 0.70 CDK4 (0.49) CDK4CCND1KMT2AHTR2AHTR2C

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
EP-2121601-B1 NOVEL INDOLE DERIVATIVES, METHODS FOR PREPARING SAME, AND USE THEREOF PARTICULARLY AS ANTIBACTERIAL AGENTS Université Joseph Fourier (FR) 2016-06-15 EP disclosed
US-8343964-B2 Indolic derivatives, their preparation processes and their uses in particular as antibacterials UNIVERSITE JOSEPH FOURIER (FR) 2013-01-01 US disclosed
US-20100144726-A1 NOVEL INDOLIC DERIVATIVES, THEIR PREPARATION PROCESSES AND THEIR USES IN PARTICULAR AS ANTIBACTERIALS UNIVERSITE JOSEPH FOURIER (FR) 2010-06-10 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-20100144726-A1 NOVEL INDOLIC DERIVATIVES, THEIR PREPARATION PROCESSES AND THEIR USES IN PARTICULAR AS ANTIBACTERIALS GPBAR1, TPH1, GPER1 SLC6A2 2403/4885CDK4 2529/4885CCND1 1259/4885

“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.