SCHEMBL2087244

SCHEMBL2087244

CC(=O)C(C)(C)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
FDPS P14324 6/20 0.43
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
CA2 P00918 1/20 0.33
SMPD1 P17405 2/20 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
SCHEMBL1336319 0.75 LMNA (0.45) LMNAFDPSPGK1PGK2CA2
SCHEMBL10580976 0.75 LMNA (0.45) LMNAFDPSPGK1PGK2CA2
SCHEMBL27006289 0.72 LMNA (0.56) LMNAFDPSPGK1PGK2CA2
SCHEMBL11165245 0.71 LMNA (0.36) LMNAFDPS
SCHEMBL8563422 0.71 ALDH1A1 (0.41) LMNAFDPS
SCHEMBL8563414 0.71 LMNA (0.41) LMNAFDPSPGK1PGK2CA2
SCHEMBL10544288 0.69 LMNA (0.39) LMNAFDPSPGK1PGK2
SCHEMBL28490987 0.69 LMNA (0.39) LMNAFDPSPGK1PGK2
SCHEMBL992 0.69 DGAT1 (0.41) LMNAFDPSPGK1PGK2CA2
SCHEMBL16216680 0.69 LMNA (0.45) LMNAFDPSPGK1PGK2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531648-B Herbicidal compounds 先正达参股股份有限公司 2021-07-13 CN disclosed
US-8198308-B2 Chemical compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-12 US disclosed
US-20110059938-A1 NEW CHEMICAL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-03-10 US disclosed
EP-2041116-A1 PHENYL SUBSTITUTED HETEROARYL-DERIVATIVES AND USE THEREOF AS ANTI-TUMOR AGENTS Boehringer Ingelheim International GmbH (DE) 2009-04-01 EP disclosed
US-20080182837-A1 NEW CHEMICAL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-07-31 US disclosed
WO-2008003770-A1 PHENYL SUBSTITUTED HETEROARYL-DERIVATIVES AND USE THEREOF AS ANTI-TUMOR AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-10 WO disclosed
EP-1309405-B1 METHOD FOR CARRYING OUT A CHEMICAL REACTION CHEMSPEED TECHNOLOGIES AG (CH) 2006-12-27 EP disclosed
US-6815463-B2 FOR THERAPY OF DISEASE OF CELLULAR HYPERPROLIFERATION IN A SUBJECT KOSAN BIOSCIENCES, INC. 2004-11-09 US disclosed
WO-2004026245-A2 SUBSTITUTED PHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY ILEX ONCOLOGY RESEARCH, SARL (CH) 2004-04-01 WO disclosed
US-6670389-B2 Useful for treating cellular hyperproliferation KOSAN BIOSCIENCES, INC. 2003-12-30 US disclosed
EP-1358186-A1 LAULIMALIDE DERIVATIVES Kosan Biosciences, Inc. (US) 2003-11-05 EP disclosed
US-20030195181-A1 Laulimalide derivatives ASHLEY GARY (US) 2003-10-16 US disclosed
US-20020128471-A1 Useful for treating cellular hyperproliferation KOSAN BIOSCIENCES, INC. 2002-09-12 US disclosed
WO-2002064589-A1 LAULIMALIDE DERIVATIVES KOSAN BIOSCIENCES, INC. (US) 2002-08-22 WO disclosed
EP-0351214-A1 Anti-inflammatory aryl derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1990-01-17 EP disclosed
US-4766213-A 1,4-dihydropyridines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-08-23 US disclosed
EP-0237695-A2 1,4-Dihydropyridines MERCK PATENT GmbH (DE) 1987-09-23 EP disclosed
EP-0210571-A1 Phosphonopyridines and their 1,4-dihydroderivatives BOEHRINGER BIOCHEMIA ROBIN S.p.A. (IT) 1987-02-04 EP disclosed
US-4073934-A Novel acetylenic prostaglandin analogs SCHERING AKTIENGESELLSCHAFT (DT) 1978-02-14 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 (4 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-20030195181-A1 Laulimalide derivatives NFATC1, MCL1, CYP51A1 LMNA 246/4885FDPS 78/4885PGK1 1550/4885
US-20110059938-A1 NEW CHEMICAL COMPOUNDS CCNA1, CCNT1, MKI67 LMNA 294/4885FDPS 1328/4885PGK1 2006/4885
US-20020128471-A1 Useful for treating cellular hyperproliferation MKI67, NFATC1, PCNA LMNA 183/4885FDPS 408/4885PGK1 763/4885
US-20080182837-A1 NEW CHEMICAL COMPOUNDS CCNA1, CCNT1, MKI67 LMNA 294/4885FDPS 1328/4885PGK1 2006/4885

“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.