SCHEMBL6449609

SCHEMBL6449609

CC(C)(C)[Si](C)(C)OC(C=O)CCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.38
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
HPGD P15428 1/20 0.36
ACE P12821 1/20 0.36
CYP24A1 Q07973 1/20 0.36
PRSS1 P07477 1/20 0.36
CTSG P08311 1/20 0.36
CTRB1 P17538 1/20 0.36
CMA1 P23946 1/20 0.36
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL15271471 1.00 BLM (0.38) BLMKMT2AALDH1A1CYP1A2CYP2C9
SCHEMBL16414800 1.00 BLM (0.38) BLMKMT2AALDH1A1CYP1A2CYP2C9
SCHEMBL6444947 0.85 MMP13 (0.36) BLMCYP24A1PRSS1CTSGCTRB1
SCHEMBL15184990 0.85 MMP13 (0.36) BLMCYP24A1PRSS1CTSGCTRB1
SCHEMBL12549853 0.84 PRSS1 (0.33) BLMCYP24A1PRSS1CTSGCTRB1
SCHEMBL7552725 0.83 PRSS1 (0.34) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL17429760 0.83 PRSS1 (0.32) BLMCYP24A1PRSS1CTSGCTRB1
SCHEMBL7552716 0.83 PRSS1 (0.34) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL4494128 0.83 PRSS1 (0.34) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL4494121 0.83 PRSS1 (0.34) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150031898-A1 PROCESS FOR PREPARATION OF PROSTAGLANDIN F2 ALPHA ANALOGUES INSTYTUT FARMACEUTYCZNY (PL) 2015-01-29 US claimed
US-20150031898-A1 PROCESS FOR PREPARATION OF PROSTAGLANDIN F2 ALPHA ANALOGUES INSTYTUT FARMACEUTYCZNY (PL) 2015-01-29 US disclosed
EP-2822927-A1 PROCESS FOR PREPARATION OF PROSTAGLANDIN F2alpha ANALOGUES INSTYTUT FARMACEUTYCZNY (PL) 2015-01-14 EP disclosed
WO-2013133730-A1 PROCESS FOR PREPARATION OF PROSTAGLANDIN F2α ANALOGUES INSTYTUT FARMACEUTYCZNY (PL) 2013-09-12 WO disclosed
EP-0839798-B1 Intermediates for preparating non-peptide retroviral protease inhibitors ABBOTT LAB (US) 2005-08-17 EP disclosed
EP-0402646-B1 Retroviral protease inhibiting compounds ABBOTT LAB (US) 1998-07-22 EP disclosed
EP-0839798-A2 Intermediates for preparating non-peptide retroviral protease inhibitors ABBOTT LABORATORIES (US) 1998-05-06 EP disclosed
US-5670675-A Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1997-09-23 US disclosed
US-5545750-A TREATING HUMAN IMMUNODEFICIENCY VIRUS ABBOTT LABORATORIES (US) 1996-08-13 US disclosed
US-5142056-A Human immunodeficiency virus protease inhibitor ABBOTT LABORATORIES (US) 1992-08-25 US disclosed
EP-0402646-A1 Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1990-12-19 EP 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-20150031898-A1 PROCESS FOR PREPARATION OF PROSTAGLANDIN F2 ALPHA ANALOGUES PTGES, PTGIS, PTGES2 BLM 2808/4885KMT2A 4092/4885ALDH1A1 968/4885

“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.