SCHEMBL6287370

SCHEMBL6287370

C[C@@](NC(=O)Cc1c[nH]c2ccccc12)(C(=O)Nc1ccc(C(OC(=O)C(F)(F)F)(c2ccc(NC(=O)[C@@](C)(NC(=O)Cc3c[nH]c4ccccc34)c3ccncc3)cc2)c2ccc(NC(=O)[C@@](C)(NC(=O)Cc3c[nH]c4ccccc34)c3ccncc3)cc2)cc1)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 1/20 0.46
GOT1 P17174 2/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
NMBR P28336 1/20 0.42
GRPR P30550 1/20 0.42
PKM P14618 1/20 0.42
HTT P42858 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
GLA P06280 1/20 0.41
HDAC1 Q13547 3/20 0.41
POLB P06746 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL6287905 0.90 ANO1 (0.45) ANO1GOT1ALDH1A1MAPTNMBR
SCHEMBL6290375 0.86 HRH3 (0.46) ANO1GOT1ALDH1A1MAPTPKM
SCHEMBL6288012 0.84 ALDH1A1 (0.43) ANO1GOT1ALDH1A1MAPTNMBR
SCHEMBL6291085 0.77 RAB9A (0.40) MAPTPOLBMEN1KMT2ACYP2D6
SCHEMBL6290998 0.76 AKR1C2 (0.44) ALDH1A1MAPTHTTHDAC1MEN1
SCHEMBL6356129 0.75 KLK6 (0.41) ALDH1A1MAPTNMBRGRPRHDAC1
SCHEMBL6287930 0.73 LMNA (0.46) GOT1MAPTHTTHDAC1
SCHEMBL7036792 0.72 HRH3 (0.51) ANO1GOT1ALDH1A1MAPTPKM
SCHEMBL6290843 0.72 LMNA (0.46) GOT1MAPTHTTHDAC1
SCHEMBL7037700 0.72 MAPT (0.49) ANO1ALDH1A1MAPTPKMHRH3

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
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK ANO1 1520/4885GOT1 2415/4885ALDH1A1 2042/4885

“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.