SCHEMBL13483552

SCHEMBL13483552

CCCCNC(=O)CCCCCCC(C)CCCCC(C)CCCCCCC(=O)NCCCOC

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
FAAH O00519 6/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HPGD P15428 2/20 0.47
DNM1 Q05193 2/20 0.47
CASP2 P42575 1/20 0.46
CNR1 P21554 1/20 0.46
MAPK1 P28482 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
NOD1 Q9Y239 1/20 0.44
ENPP2 Q13822 1/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
NAAA Q02083 1/20 0.44
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL14065638 0.97 TSHR (0.61) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL12299083 0.97 TSHR (0.61) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL12934641 0.97 TSHR (0.61) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL13023957 0.94 TSHR (0.61) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL4264199 0.94 TSHR (0.69) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL12090657 0.94 TSHR (0.69) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL23787581 0.93 TSHR (0.67) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL12299088 0.90 TSHR (0.63) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL12840596 0.90 TSHR (0.63) TSHRFAAHMEN1KMT2AHPGD
SCHEMBL13656030 0.89 TSHR (0.76) TSHRFAAHMEN1KMT2AHPGD

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-7655220-B2 N,N'-Bis(alkoxyalkyl) aliphatic dicarboxamide and an alkail agent; pH of 12-14 when diluted to10 times with water KAO CORPORATION (JP) 2010-02-02 US disclosed
US-7655220-B2 N,N'-Bis(alkoxyalkyl) aliphatic dicarboxamide and an alkail agent; pH of 12-14 when diluted to10 times with water KAO CORPORATION (JP) 2010-02-02 US disclosed
US-20070110692-A1 HAIR STRAIGHTENER COMPOSITION KAO CORPORATION (JP) 2007-05-17 US disclosed
US-20070110692-A1 HAIR STRAIGHTENER COMPOSITION KAO CORPORATION (JP) 2007-05-17 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-20070110692-A1 HAIR STRAIGHTENER COMPOSITION H1-10, H1-0, SHH TSHR 2304/4885FAAH 2103/4885MEN1 657/4885

“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.