SCHEMBL5014622

SCHEMBL5014622

COc1cc2c(c(OC)c1OC)-c1cc3c(cc1[C@@H](O)[C@H]1COC(=O)[C@@H]1C2)OCO3

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.54
LMNA P02545 5/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
CYP2C9 P11712 2/20 0.54
MAPK1 P28482 2/20 0.54
CYP2C19 P33261 2/20 0.54
HIF1A Q16665 2/20 0.54
MAPT P10636 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
TUBB4A P04350 2/20 0.54
TUBB P07437 2/20 0.54
TUBA3C P0DPH7 2/20 0.54
TUBA1B P68363 2/20 0.54
TUBA4A P68366 2/20 0.54
TUBB4B P68371 2/20 0.54
TUBB3 Q13509 2/20 0.54
TUBB2A Q13885 2/20 0.54
TUBB8 Q3ZCM7 2/20 0.54
TUBA3E Q6PEY2 2/20 0.54
TUBA1A Q71U36 2/20 0.54

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
SCHEMBL14097830 1.00 CYP3A4 (0.54) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
Steganacin SCHEMBL66054 0.86 LMNA (0.57) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
Steganacin SCHEMBL14138211 0.86 LMNA (0.57) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
(-)-Steganacin SCHEMBL10065023 0.86 LMNA (0.57) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
SCHEMBL9951919 0.81 GSK3B (0.47) CYP3A4LMNACYP2C9MAPK1CYP2C19
Stegane SCHEMBL5014561 0.80 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Picrostegane SCHEMBL14097820 0.80 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Steganacin SCHEMBL8044045 0.77 CYP3A4 (0.48) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
SCHEMBL19050768 0.77 CYP3A4 (0.53) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1
SCHEMBL14363336 0.77 CYP3A4 (0.54) CYP3A4LMNASMN1; SMN2CYP2C9MAPK1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194678-A1 Process To Obtain Synthetic And Semi-Synthetic Lignan Derivatives, Their Antiparasitic Activities And Corresponding Pharmaceutical Formulations, Including The Therapeutic Method Using Said Lignan For The Treatment Of Parasitosis FUNDACAO DE AMPARO A PESQUISSA DO ESTADO DE AAO PA (BR) 2008-08-14 US claimed
EP-1907380-A2 PROCESS TO OBTAIN SYNTHETIC AND SEMI-SYNTHETIC LIGNAN DERIVATIVES, THEIR ANTIPARASITIC ACTIVITIES AND CORRESPONDING PHARMACEUTICAL FORMULATIONS, INCLUDING THE THERAPEUTIC METHOD USING SAID LIGNAN FOR THE TREATMENT OF PARASITOSIS Fundação de Amparo à Pesquisa do Estado de São Paulo - FAPESP (BR) 2008-04-09 EP claimed
WO-2007009201-A2 PROCESS TO OBTAIN SYNTHETIC AND SEMI-SYNTHETIC LIGNAN DERIVATIVES, THEIR ANTIPARASITIC ACTIVITIES AND CORRESPONDING PHARMACEUTICAL FORMULATIONS, INCLUDING THE THERAPEUTIC METHOD USING SAID LIGNAN FOR THE TREATMENT OF PARASITOSIS Fundação De Amparo À Pesquisa Do Estado de São Paulo (BR) 2007-01-25 WO claimed
CN-118063558-A Polypeptide with anti-pulmonary fibrosis effect and application thereof 南方科技大学 2024-05-24 CN disclosed
US-20080194678-A1 Process To Obtain Synthetic And Semi-Synthetic Lignan Derivatives, Their Antiparasitic Activities And Corresponding Pharmaceutical Formulations, Including The Therapeutic Method Using Said Lignan For The Treatment Of Parasitosis FUNDACAO DE AMPARO A PESQUISSA DO ESTADO DE AAO PA (BR) 2008-08-14 US disclosed
EP-1907380-A2 PROCESS TO OBTAIN SYNTHETIC AND SEMI-SYNTHETIC LIGNAN DERIVATIVES, THEIR ANTIPARASITIC ACTIVITIES AND CORRESPONDING PHARMACEUTICAL FORMULATIONS, INCLUDING THE THERAPEUTIC METHOD USING SAID LIGNAN FOR THE TREATMENT OF PARASITOSIS Fundação de Amparo à Pesquisa do Estado de São Paulo - FAPESP (BR) 2008-04-09 EP disclosed
WO-2007009201-A2 PROCESS TO OBTAIN SYNTHETIC AND SEMI-SYNTHETIC LIGNAN DERIVATIVES, THEIR ANTIPARASITIC ACTIVITIES AND CORRESPONDING PHARMACEUTICAL FORMULATIONS, INCLUDING THE THERAPEUTIC METHOD USING SAID LIGNAN FOR THE TREATMENT OF PARASITOSIS Fundação De Amparo À Pesquisa Do Estado de São Paulo (BR) 2007-01-25 WO disclosed
US-4059593-A Synthesis of steganacin and derivatives thereof UNIVERSITY OF ROCHESTER (US) 1977-11-22 US disclosed
US-4003916-A ANTI-LEUKEMIC AGENTS; DIBENZO-CYCLOOCTADIENE LIGNIN LACTONES; SAPONIFICATION KENDE ANDREW S 1977-01-18 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-20080194678-A1 Process To Obtain Synthetic And Semi-Synthetic Lignan Derivatives, Their Antiparasitic Activities And Corresponding Pharmaceutical Formulations, Including The Therapeutic Method Using Said Lignan For The Treatment Of Parasitosis HRH4, NISCH, CCNB3 CYP3A4 259/4885LMNA 813/4885SMN1; SMN2 3844/4885

“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.