SCHEMBL11074142

SCHEMBL11074142

OCCN(CCO)c1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
HRH3 Q9Y5N1 1/20 0.40
KMT2A Q03164 5/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 4/20 0.39
CYP2A6 P11509 1/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
USP2 O75604 1/20 0.37
RECQL P46063 1/20 0.37
TLR9 Q9NR96 1/20 0.37
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL6243535 0.87 MAPT (0.44) POLBKMT2AMAPTMEN1LMNA
SCHEMBL8686227 0.87 ALDH1A1 (0.46) POLBKMT2AMAPTMEN1LMNA
SCHEMBL9807489 0.86 LSS (0.38) POLBHRH3KMT2AMAPTMEN1
Hydrochloric Acid SCHEMBL8038931 0.85 MAPT (0.43) POLBKMT2AMAPTMEN1LMNA
SCHEMBL9807501 0.83 LSS (0.39) POLBHRH3KMT2AMAPTMEN1
SCHEMBL2006984 0.80 KMT2A (0.41) POLBKMT2AMAPTMEN1LMNA
SCHEMBL3675298 0.78 CA2 (0.42) POLBKMT2AMAPTMEN1LMNA
SCHEMBL5853973 0.77 L3MBTL1 (0.46) POLBMAPTCYP2A6ALDH1A1L3MBTL1
SCHEMBL6573029 0.77 HRH3 (0.38) POLBHRH3KMT2AMAPTMEN1
SCHEMBL25205713 0.76 MAPT (0.73) POLBKMT2AMAPTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962670-B2 Anti-cancer agents UWM RESEARCH FOUNDATION, INC. (US) 2015-02-24 US disclosed
US-8962670-B2 Anti-cancer agents UWM RESEARCH FOUNDATION, INC. (US) 2015-02-24 US disclosed
US-8637490-B2 Anti-cancer agents UWM RESEARCH FOUNDATION, INC. (US) 2014-01-28 US disclosed
US-8637490-B2 Anti-cancer agents UWM RESEARCH FOUNDATION, INC. (US) 2014-01-28 US disclosed
US-20130045949-A1 ANTI-CANCER AGENTS UWM RESEARCH FOUNDATION, INC. (US) 2013-02-21 US disclosed
US-20130045949-A1 ANTI-CANCER AGENTS UWM RESEARCH FOUNDATION, INC. (US) 2013-02-21 US disclosed
EP-0001290-B1 SUBSTITUTED 2,3-DIHYDROBENZ-(D)-ISOTHIAZOLE-1,1-DIOXIDES AND 2,3-DIHYDRONAPHTHO-(1,8-DE)-1,2-THIAZINE-1,1-DIOXIDES POLAROID CORPORATION (US) 1984-06-27 EP disclosed
US-4359574-A Thiazine-1,1-dioxide and isothiazole-1,1-dioxide derivatives POLAROID CORPORATION (US) 1982-11-16 US disclosed
US-4311839-A Benzisothiazole and naphtho-1,2-thiazine compounds POLAROID CORPORATION (US) 1982-01-19 US disclosed
US-4283537-A Thiazine-1,1-dioxide and isothiazole-1,1-dioxide derivatives and process for preparation POLAROID CORPORATION (US) 1981-08-11 US disclosed
US-4259493-A INDICATOR DYES OR PHOTOGRAPHIC LIGHT-SCREENING DYES POLAROID CORPORATION (US) 1981-03-31 US disclosed
US-4255578-A Synthesis of perhalomethylcarbinol-substituted phenol and naphthol sulfamphthalein dyes from the corresponding triacylated derivatives POLAROID CORPORATION (US) 1981-03-10 US disclosed
US-4210752-A Synthesis of substituted sulfam(na)phthaleins POLAROID CORPORATION (US) 1980-07-01 US disclosed
US-4186001-A IRREVERSIBLE CLEAVAGE IN ALKALINE SOLUTION TO FORM COLORLESS COMPOUND POLAROID CORPORATION (US) 1980-01-29 US disclosed
US-4178447-A Novel synthesis of 3,3-substituted dihydrobenzisothiazole-1,1-dioxides and -2,3-dihydronaphtho-1,2-thiazine-1,1-dioxides POLAROID CORPORATION (US) 1979-12-11 US disclosed
US-4172083-A Carbocyclic aryl compounds substituted with a tetrahydro-2H,4H-1,3,6-dioxazocino moiety POLAROID CORPORATION (US) 1979-10-23 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 (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-20130045949-A1 ANTI-CANCER AGENTS TP53, MCL1, HRAS POLB 650/4885HRH3 3865/4885KMT2A 3226/4885

“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.