SCHEMBL13096293

SCHEMBL13096293

CC(C)OC1OCC(O)C(O)C1O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYR P14679 5/20 0.46
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
CA1 P00915 1/20 0.33
TACR1 P25103 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
SCHEMBL18622063 1.00 TYR (0.46) TYRTHRBLMNACA12CA9
SCHEMBL26385620 1.00 TYR (0.46) TYRTHRBLMNACA12CA9
SCHEMBL11034505 0.95 TYR (0.42) TYRTHRBLMNACA12CA9
SCHEMBL6930937 0.95 TYR (0.42) TYRTHRBLMNACA12CA9
SCHEMBL26443544 0.83 TYR (0.35) TYR
SCHEMBL25976247 0.83 TYR (0.35) TYR
SCHEMBL11082587 0.82 TYR (0.50) TYRTHRBCA12CA9CA1
SCHEMBL11080316 0.79 TYR (0.42) TYRTHRBLMNACA12CA9
SCHEMBL6932467 0.78 TYR (0.32) TYR
SCHEMBL23488810 0.78 TYR (0.41) TYRTACR1

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
WO-2017103790-A1 HYDROPHILIZED POLYDIORGANOSILOXANE VINYLIC CROSSLINKERS AND USES THEREOF NOVARTIS AG (CH) 2017-06-22 WO disclosed
WO-2017096311-A1 CONJUGATES OF QUATERNIZED TUBULYSIN COMPOUNDS SEATTLE GENETICS, INC. (US) 2017-06-08 WO disclosed
US-20100267653-A1 USE OF COUMARIN DERIVATIVES IN ANTIFUNGAL THERAPY NOVABIOTICS LIMITED (GB) 2010-10-21 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-20100267653-A1 USE OF COUMARIN DERIVATIVES IN ANTIFUNGAL THERAPY DPM1, XPO5, NISCH TYR 325/4885THRB 4818/4885LMNA 3062/4885

“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.