SCHEMBL3346077

SCHEMBL3346077

Cc1nc(-c2ccc(OCCCCOc3ccc(C(N)=NO)cc3)cc2)c(C(C)C)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
RAB9A P51151 2/20 0.51
LMNA P02545 2/20 0.51
MAPT P10636 2/20 0.51
NPC1 O15118 1/20 0.51
TP53 P04637 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
SLC2A1 P11166 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
RARB P10826 1/20 0.36
GFER P55789 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PLAU P00749 3/20 0.35
PLG P00747 2/20 0.35
PRSS1 P07477 2/20 0.35
F2 P00734 1/20 0.35
PRMT1 Q99873 1/20 0.35
ST14 Q9Y5Y6 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
SCHEMBL3666899 0.99 GAA (0.53) GAARAB9ALMNAMAPTNPC1
SCHEMBL13686121 0.99 GAA (0.53) GAARAB9ALMNAMAPTNPC1
SCHEMBL12213745 0.99 GAA (0.53) GAARAB9ALMNAMAPTNPC1
SCHEMBL3192337 0.87 PRSS1 (0.52) PLAUPLGPRSS1F2PRMT1
SCHEMBL11936601 0.86 MEN1 (0.38) GAARAB9ALMNAMAPTNPC1
SCHEMBL727965 0.86 PRMT1 (0.53) PLAUPLGPRSS1F2PRMT1
Hydrochloric Acid SCHEMBL3241146 0.85 PRSS1 (0.54) PLAUPLGPRSS1F2PRMT1
SCHEMBL3262577 0.81 MEN1 (0.39) GAAKMT2AMEN1RARBL3MBTL1
SCHEMBL729234 0.80 MEN1 (0.38) KMT2AMEN1RARBPLAUPLG
SCHEMBL12213750 0.80 CYP19A1 (0.45) RAB9ALMNAMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242152-B2 Use of 4-[(4-thiazolyl)phenoxy]alkoxy-benzamidine derivatives for the prophylaxis and treatment of osteoporosis DONG WHA PHARMACEUTICAL CO., LTD. (KR) 2012-08-14 US disclosed
US-20100160394-A1 USE OF 4-[(4- THIAZOLYL)PHENOXY]ALKOXY-BENZAMIDINE DERIVATIVES FOR THE PROPHYLAXIS AND TREATMENT OF OSTEOPOROSIS DONGWHA PHARMACEUTICAL CO., LTD. 2010-06-24 US disclosed
EP-1411935-A4 USE OF 4- (4-THIAZOLYL)PHENOXL] ALKOXY-BENZAMIDINE DERIVATIVES FOR TREATMENT OF OSTEOPOROSIS DONG WHA PHARM IND CO LTD (KR) 2005-11-09 EP disclosed
EP-1411935-A1 USE OF 4- (4-THIAZOLYL)PHENOXL] ALKOXY-BENZAMIDINE DERIVATIVES FOR TREATMENT OF OSTEOPOROSIS DONG WHA PHARMACEUTICAL INDUSTRIAL CO. LTD. (KR) 2004-04-28 EP disclosed
WO-2003007947-A1 USE OF 4-[(4-THIAZOLYL)PHENOXL] ALKOXY-BENZAMIDINE DERIVATIVES FOR TREATMENT OF OSTEOPOROSIS DONG WHA PHARM. IND. CO., LTD. (KR) 2003-01-30 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 (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-20100160394-A1 USE OF 4-[(4- THIAZOLYL)PHENOXY]ALKOXY-BENZAMIDINE DERIVATIVES FOR THE PROPHYLAXIS AND TREATMENT OF OSTEOPOROSIS SOST, PTH1R, PTMS GAA 2177/4885RAB9A 2561/4885LMNA 1454/4885

“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.