SCHEMBL25815131

SCHEMBL25815131

CC1COc2ccc(C(C)(C)C)cc2OCCCOc2ccc(C(C)(C)C)cc2OC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.41
TRPV1 Q8NER1 9/20 0.41
ALDH1A1 P00352 1/20 0.38
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
MTOR P42345 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HPGD P15428 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
SCHEMBL23024716 0.92 CYP19A1 (0.46) CYP19A1TRPV1ALDH1A1MAPTRAB9A
SCHEMBL22134735 0.88 TRPV1 (0.46) TRPV1TSHRSMN1; SMN2MEN1MAPT
SCHEMBL9883695 0.88 TRPV1 (0.46) TRPV1TSHRSMN1; SMN2MEN1MAPT
SCHEMBL22134641 0.86 TRPV1 (0.43) CYP19A1TRPV1ALDH1A1TSHRSMN1; SMN2
SCHEMBL12744647 0.85 TRPV1 (0.46) TRPV1TSHRSMN1; SMN2MEN1MAPT
SCHEMBL14499098 0.83 RAB9A (0.45) CYP19A1TRPV1TSHRSMN1; SMN2MEN1
SCHEMBL22134742 0.82 TRPV1 (0.39) CYP19A1TRPV1ALDH1A1TSHRSMN1; SMN2
SCHEMBL84835 0.81 TRPV1 (0.49) TRPV1TSHRSMN1; SMN2MEN1MAPT
SCHEMBL25815137 0.80 CYP19A1 (0.38) CYP19A1TRPV1ALDH1A1TSHRSMN1; SMN2
SCHEMBL25815406 0.79 CYP19A1 (0.38) CYP19A1TRPV1ALDH1A1MAPTRAB9A

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 CYP19A1 4811/4885TRPV1 434/4885ALDH1A1 4352/4885

“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.