SCHEMBL9994635

SCHEMBL9994635

CC(C)OC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@H](O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 4/20 0.55
CTSS P25774 4/20 0.55
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
CTSB P07858 2/20 0.50
ATM Q13315 2/20 0.50
CYP3A4 P08684 6/20 0.49
CTSK P43235 3/20 0.49
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TSHR P16473 5/20 0.48
CYP2C9 P11712 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL9994634 1.00 CTSL (0.55) CTSLCTSSMEN1KMT2ACTSB
SCHEMBL15317912 1.00 CTSL (0.55) CTSLCTSSMEN1KMT2ACTSB
SCHEMBL8150285 0.88 TRPM8 (0.58) CTSLCTSSMEN1KMT2AATM
SCHEMBL12069024 0.88 TRPM8 (0.58) CTSLCTSSMEN1KMT2AATM
SCHEMBL15312880 0.87 HTT (0.44) CTSLCTSSMEN1KMT2AATM
SCHEMBL15312882 0.87 HTT (0.44) CTSLCTSSMEN1KMT2AATM
SCHEMBL10806439 0.85 CTSL (0.47) CTSLCTSSMEN1KMT2ACTSB
SCHEMBL9830841 0.85 CTSL (0.54) CTSLCTSSMEN1KMT2ACTSB
SCHEMBL16587917 0.85 CTSL (0.54) CTSLCTSSMEN1KMT2ACTSB
SCHEMBL9830850 0.85 CTSL (0.54) CTSLCTSSMEN1KMT2ACTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987504-B2 Aminohydroxylation of alkenes VICTORIA LINK LIMITED (NZ) 2015-03-24 US disclosed
US-8987504-B2 Aminohydroxylation of alkenes VICTORIA LINK LIMITED (NZ) 2015-03-24 US disclosed
US-20130274479-A1 AMINOHYDROXYLATION OF ALKENES INDUSTRIAL RESEARCH LIMITED (NZ) 2013-10-17 US disclosed
US-20130274479-A1 AMINOHYDROXYLATION OF ALKENES INDUSTRIAL RESEARCH LIMITED (NZ) 2013-10-17 US disclosed
WO-2011159177-A1 IMPROVED AMINOHYDROXYLATION OF ALKENES INDUSTRIAL RESEARCH LIMITED (NZ) 2011-12-22 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-20130274479-A1 AMINOHYDROXYLATION OF ALKENES ALKBH3, ALKBH1, ALKBH2 CTSL 1494/4885CTSS 2286/4885MEN1 3894/4885

“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.