SCHEMBL5862701

SCHEMBL5862701

CCCCCCCC(Cl)(Cl)CO

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
FDPS P14324 10/20 0.43
SMPD1 P17405 2/20 0.43
GGPS1 O95749 6/20 0.41
THRB P10828 1/20 0.40

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
SCHEMBL398718 1.00 TSHR (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
Methyl Alcohol SCHEMBL9146394 0.98 FDPS (0.42) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL2454205 0.97 FDPS (0.41) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL1929155 0.90
SCHEMBL9223093 0.89 LMNA (0.39) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL1639544 0.84 TSHR (0.50) TSHRALDH1A1FDPSSMPD1GGPS1
SCHEMBL3346971 0.84 TSHR (0.50) TSHRALDH1A1FDPSSMPD1GGPS1
SCHEMBL7508589 0.83 LMNA (0.62) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL1098322 0.83 LMNA (0.48) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL2166623 0.83 LMNA (0.48) TSHRALDH1A1LMNAHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6992097-B2 Growth hormone secretagogues ELI LILLY AND COMPANY (US) 2006-01-31 US disclosed
US-20050143318-A1 Growth hormone secretagogues DODGE JEFFREY A (US) 2005-06-30 US disclosed
US-20040122234-A1 Growth Hormone secretagogues HAUSER KENNETH LEE (US) 2004-06-24 US disclosed
US-6639076-B1 Such as 2-(2-amino-2-methylpropanoylamino)-n-(1-(2-oxo-1-phenyl-2-pyrrolidinylethyl -4-yl)-4-phenylbutanamide ELI LILLY AND COMPANY 2003-10-28 US disclosed
EP-0948483-B1 FARNESYL TRANSFERASE INHIBITORS AVENTIS PHARMA SA (FR) 2002-03-13 EP disclosed
US-6329342-B1 CARDIOVASCULAR DISORDERS ELI LILLY AND COMPANY 2001-12-11 US disclosed
EP-0948483-A1 FARNESYL TRANSFERASE INHIBITORS Aventis Pharma S.A. (FR) 1999-10-13 EP disclosed
WO-1998029390-A1 FARNESYL TRANSFERASE INHIBITORS RHONE-POULENC RORER S.A. (FR) 1998-07-09 WO disclosed
US-4851441-A Antiviral guanidine derivatives compositions and their methods of use HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1989-07-25 US disclosed
US-4772609-A Antiviral guanidine derivatives and compositions therefor HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1988-09-20 US disclosed
EP-0271571-A1 ANTIVIRAL GUANIDINE DERIVATIVE COMPOSITIONS AND THEIR METHODS OF USE HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1988-06-22 EP disclosed
WO-1988000181-A1 ANTIVIRAL GUANIDINE DERIVATIVE COMPOSITIONS AND THEIR METHODS OF USE HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1988-01-14 WO 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-20050143318-A1 Growth hormone secretagogues GHSR, GHRHR, SSTR3 TSHR 28/4885ALDH1A1 4506/4885LMNA 4625/4885
US-20040122234-A1 Growth Hormone secretagogues GHSR, GHRHR, CRH TSHR 40/4885ALDH1A1 4382/4885LMNA 4469/4885

“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.