SCHEMBL21135289

SCHEMBL21135289

CCC1(C)OCC(COC(=O)CCC(=O)OC)O1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.40
TSHR P16473 1/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.35
PRKCA P17252 2/20 0.33
POLB P06746 1/20 0.33
CA2 P00918 1/20 0.33
LPAR1 Q92633 1/20 0.32
LPAR3 Q9UBY5 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
SCHEMBL21136083 0.94 CTDSP1 (0.43) CTDSP1LMNAMEN1KMT2AALDH1A1
SCHEMBL21135305 0.89 CTDSP1 (0.41) CTDSP1LMNAPOLBLPAR1LPAR3
SCHEMBL10078999 0.85 CTDSP1 (0.36) CTDSP1TSHRLMNAALDH1A1POLB
SCHEMBL21135290 0.85 CTDSP1 (0.47) CTDSP1LMNAPOLBLPAR1LPAR3
SCHEMBL21135291 0.84 CA2 (0.48) TSHRLMNAALDH1A1POLBCA2
SCHEMBL14981029 0.84 CTDSP1 (0.36) CTDSP1TSHRLMNAALDH1A1PRKCA
SCHEMBL14531520 0.83 CTDSP1 (0.36) CTDSP1TSHRLMNAALDH1A1PRKCA
SCHEMBL19652556 0.82 PRKCA (0.43) PRKCALPAR1LPAR3
SCHEMBL25987173 0.82 CTDSP1 (0.42) CTDSP1LMNAMEN1KMT2AALDH1A1
SCHEMBL19652560 0.81 PRKCA (0.45) PRKCALPAR1LPAR3

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-20190194157-A1 COALESCING AGENT DERIVED FROM DIOXOLANE DERIVATIVES PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) 2019-06-27 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-20190194157-A1 COALESCING AGENT DERIVED FROM DIOXOLANE DERIVATIVES ITCH, RNF168, DCTN1 CTDSP1 2457/4885TSHR 3672/4885LMNA 2708/4885

“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.