SCHEMBL10144746

SCHEMBL10144746

CSCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(Br)c1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.61
TSHR P16473 1/20 0.61
KIF11 P52732 1/20 0.59
ALDH1A1 P00352 1/20 0.55
PKM P14618 1/20 0.53
PDE1C Q14123 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL5352815 0.88 KIF11 (0.65) POLBKIF11ALDH1A1PKM
SCHEMBL5352781 0.87 KIF11 (0.77) KIF11ALDH1A1PKMSMN1; SMN2
SCHEMBL10113145 0.85 HSD17B10 (0.67) POLBKIF11PKM
SCHEMBL5343438 0.84 POLB (0.63) POLBKIF11PKMPDE1CSMN1; SMN2
SCHEMBL5337520 0.83 MAPT (0.66) POLBKIF11PKM
SCHEMBL10113135 0.79 GAA (0.64) POLBKIF11ALDH1A1PKM
SCHEMBL10113437 0.79 ADORA2B (0.61) KIF11ALDH1A1PKM
SCHEMBL16457636 0.79 TSHR (0.70) TSHRPKM
SCHEMBL7688891 0.76 ALDH1A1 (0.61) POLBALDH1A1
SCHEMBL5340534 0.75 KIF11 (0.80) POLBTSHRKIF11ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 POLB 2362/4885TSHR 2802/4885KIF11 3347/4885

“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.