SCHEMBL25815359

SCHEMBL25815359

COC(=O)COC1COc2ccc(C(C)(C)C)cc2OCCCOc2ccc(C(C)(C)C)cc2OC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TRPV1 Q8NER1 11/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.40
HSP90AA1 P07900 1/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
MTOR P42345 1/20 0.38
NPC1 O15118 1/20 0.37
CYP19A1 P11511 1/20 0.37

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
SCHEMBL25815122 0.90 ALDH1A1 (0.42) ALDH1A1NPSR1SMN1; SMN2TRPV1MAPT
SCHEMBL22134638 0.89 ALDH1A1 (0.41) ALDH1A1NPSR1SMN1; SMN2TRPV1MAPT
SCHEMBL22134636 0.82 CYP19A1 (0.44) ALDH1A1SMN1; SMN2TRPV1MAPTLMNA
SCHEMBL22134640 0.82 MAPT (0.38) ALDH1A1SMN1; SMN2TRPV1MAPTLMNA
SCHEMBL25815406 0.81 CYP19A1 (0.38) ALDH1A1TRPV1MAPTLMNAHTT
SCHEMBL25815480 0.80 TRPV1 (0.35) ALDH1A1SMN1; SMN2TRPV1MAPTLMNA
SCHEMBL25814633 0.78 CYP19A1 (0.36) ALDH1A1SMN1; SMN2TRPV1MAPTLMNA
SCHEMBL22134634 0.77 CYP19A1 (0.39) SMN1; SMN2TRPV1MAPTMEN1KMT2A
SCHEMBL25815119 0.76 FFAR1 (0.39) ALDH1A1NPSR1SMN1; SMN2TRPV1MAPT
SCHEMBL22134641 0.75 TRPV1 (0.43) ALDH1A1SMN1; SMN2TRPV1MAPTLMNA

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-20230219919-A1 LITHIUM EXTRACTION WITH CROWN ETHERS ORCA HOLDINGS, LLC 2023-07-13 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-20230219919-A1 LITHIUM EXTRACTION WITH CROWN ETHERS LCLAT1, LCT, IGF2R ALDH1A1 4352/4885NPSR1 2626/4885SMN1; SMN2 4559/4885

“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.