SCHEMBL4186308

SCHEMBL4186308

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nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 2/20 0.33
CTSA P10619 1/20 0.33
MAPT P10636 1/20 0.33
NSD2 O96028 1/20 0.33
SETD2 Q9BYW2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL4172572 0.84 S1PR3 (0.41) TRPM8HTTMAPK1LMNAMAPT
SCHEMBL4185424 0.83 TRPM8 (0.36) TRPM8L3MBTL1HTTNPC1ALOX12
SCHEMBL4178016 0.80 HTT (0.44) HTTLMNASMN1; SMN2HPGDALOX15
SCHEMBL4186450 0.74 HTT (0.56) HTTMAPK1LMNASMN1; SMN2HPGD
SCHEMBL14101230 0.74 ALDH1A1 (0.38) TRPM8HTTNPC1MAPK1LMNA
SCHEMBL31445583 0.71 AKR1C3 (0.45) TRPM8L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL3196849 0.70 CTSK (0.39) TRPM8HTTMAPK1LMNAMAPT
SCHEMBL15871726 0.69 TRPM8 (0.52) TRPM8L3MBTL1HTTNPC1LMNA
SCHEMBL18827519 0.69 TRPM8 (0.39) TRPM8L3MBTL1HTTNPC1MAPK1
SCHEMBL23886543 0.69 NAPRT (0.43) TRPM8L3MBTL1HTTMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
EP-1942109-A1 TAXANE COMPOUND WITH AZETIDINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2008-07-09 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-20090186868-A1 Taxane Compound Having Azetidine Ring Structure ABCC1, AZI2, TPD52L2 TRPM8 4849/4885L3MBTL1 1661/4885HTT 2412/4885

“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.