SCHEMBL15042882

SCHEMBL15042882

CC(C)c1ccc2c(c1)OCc1[nH]c(C(C)C)cc1-2

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
KIF11 P52732 2/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 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
SCHEMBL15042853 0.78 LMNA (0.34) LMNALTB4RLTB4R2KIF11HPGD
SCHEMBL2706594 0.74 LMNA (0.41) LMNALTB4RLTB4R2
SCHEMBL15042899 0.74 LMNA (0.38) LMNAMAPTPTGS1KIF11HPGD
SCHEMBL2705602 0.73 KDM4E (0.33) LMNALTB4RLTB4R2SMN1; SMN2TP53
SCHEMBL2756725 0.73 LMNA (0.36) LMNALTB4RLTB4R2SMN1; SMN2TP53
SCHEMBL15042891 0.73 LMNA (0.37) LMNASMN1; SMN2MAPTKIF11HPGD
SCHEMBL13719507 0.71 MAOB (0.43) LMNALTB4RLTB4R2MAPTPTGS1
SCHEMBL13465062 0.70 LMNA (0.41) LMNALTB4RLTB4R2
SCHEMBL15042885 0.70 HPGD (0.40) LMNAHPGD
SCHEMBL15042910 0.69 HPGD (0.33) LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796705-B2 Fused tricyclic compounds and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2017-10-24 US disclosed
US-9796705-B2 Fused tricyclic compounds and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2017-10-24 US disclosed
US-20170008879-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2017-01-12 US disclosed
US-20130156731-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEAS SCHERING CORPORATION 2013-06-20 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 (2 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-20130156731-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEAS HAVCR2, ELOC, ZC3HAV1 LMNA 1245/4885LTB4R 1835/4885LTB4R2 1668/4885
US-20170008879-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES ZC3HAV1, HAVCR2, ZC3HAV1L LMNA 705/4885LTB4R 3428/4885LTB4R2 3456/4885

“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.