SCHEMBL26201200

SCHEMBL26201200

C[C@H]1C=C(COC(=O)C(C)(C)C)[C@H]2C[C@@H]1C2(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.33
NPC1 O15118 2/20 0.32
CNR1 P21554 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
CYP19A1 P11511 2/20 0.30
CYP17A1 P05093 1/20 0.30

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
SCHEMBL821494 0.86 ELANE (0.33) CNR2NPC1CNR1CYP1A2CYP2C9
SCHEMBL17388254 0.86 ELANE (0.33) CNR2NPC1CNR1CYP1A2CYP2C9
SCHEMBL14562352 0.86 ELANE (0.33) CNR2NPC1CNR1CYP1A2CYP2C9
SCHEMBL17414527 0.86 ELANE (0.33) CNR2NPC1CNR1CYP1A2CYP2C9
SCHEMBL31320358 0.86 ELANE (0.33) CNR2NPC1CNR1CYP1A2CYP2C9
SCHEMBL27026223 0.75 CNR2 (0.56) CNR2CNR1
SCHEMBL20192086 0.75 NPC1 (0.33) NPC1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL24281979 0.74 TDP1 (0.46) KMT2AKDM4E
SCHEMBL18944058 0.74 ELANE (0.34) CNR2NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL24281977 0.74 ELANE (0.34) CNR2NPC1CYP1A2CYP2C9CYP2C19

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-20230271908-A1 METHODS, PROCESSES, AND COMPOSITIONS FOR IMPROVED PREPARATION OF HU308 AND HU433 TETRA BIO-PHARMA INC. (CA) 2023-08-31 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-20230271908-A1 METHODS, PROCESSES, AND COMPOSITIONS FOR IMPROVED PREPARATION OF HU308 AND HU433 CYP3A43, PRMT8, MGMT CNR2 2295/4885NPC1 3226/4885CNR1 2102/4885

“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.