SCHEMBL4010658

SCHEMBL4010658

COC(=O)CCCCCCCCCCCSC

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
LMNA P02545 2/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 3/20 0.43
RECQL P46063 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
GLA P06280 1/20 0.41
EPHX2 P34913 4/20 0.40
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.39
POLA1 P09884 1/20 0.39
MEN1 O00255 2/20 0.39

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
SCHEMBL16281094 1.00 TSHR (0.58) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL22813743 0.98 TSHR (0.61) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL628936 0.91
SCHEMBL11613489 0.84 TSHR (0.61) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL9105726 0.84 TSHR (0.61) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL11612260 0.84 TSHR (0.61) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL494114 0.83 TSHR (0.82) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL3502791 0.83 TSHR (0.82) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL494299 0.83 TSHR (0.82) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL3503548 0.83 TSHR (0.82) TSHRLMNAALDH1A1KMT2ARECQL

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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 US disclosed
US-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 US disclosed
US-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 US disclosed
WO-2009077844-A2 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA QUONOVA LLC (US) 2009-06-25 WO 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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA PGLS, TFPI, Q6ZSR9 TSHR 3859/4885LMNA 4134/4885ALDH1A1 4657/4885

“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.