SCHEMBL414431

SCHEMBL414431

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nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KDM4E B2RXH2 2/20 0.35
TRPA1 O75762 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
SCHEMBL15496474 1.00 TSHR (0.47) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL12409518 1.00 TSHR (0.47) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL16280839 0.92 TSHR (0.47) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL632560 0.92 TSHR (0.47) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL15704275 0.92 TSHR (0.47) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL11974290 0.87 TSHR (0.44) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL17528489 0.87 LMNA (0.69) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL13893119 0.87 TSHR (0.44) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL13296278 0.87 TSHR (0.44) TSHRLMNAL3MBTL1TDP1ALDH1A1
SCHEMBL15895192 0.87 LMNA (0.69) TSHRLMNAL3MBTL1TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160235736-A1 ANTIMICROBIAL COMPOSITIONS MELINTA SUBSIDIARY CORP. 2016-08-18 US disclosed
US-20150366857-A1 Antimicrobial Compositions with Effervescent Agents MELINTA SUBSIDIARY CORP. 2015-12-24 US disclosed
US-20150366858-A1 Methods for Treating Infections MELINTA SUBSIDIARY CORP. (F/K/A MELINTA THERAPEUTICS, INC.) 2015-12-24 US disclosed
US-20120065186-A1 ANTIMICROBIAL COMPOSITIONS RIB-X PHARMACEUTICALS, INC. 2012-03-15 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 (4 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-20160235736-A1 ANTIMICROBIAL COMPOSITIONS NOD2, QPCT, IFNG TSHR 4804/4885LMNA 2946/4885L3MBTL1 3140/4885
US-20150366858-A1 Methods for Treating Infections LPO, FABP2, IL5 TSHR 4058/4885LMNA 4060/4885L3MBTL1 1869/4885
US-20150366857-A1 Antimicrobial Compositions with Effervescent Agents OPA1, FPR1, NOD2 TSHR 4814/4885LMNA 3017/4885L3MBTL1 4433/4885
US-20120065186-A1 ANTIMICROBIAL COMPOSITIONS NOD2, QPCT, IFNG TSHR 4804/4885LMNA 2946/4885L3MBTL1 3140/4885

“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.