SCHEMBL336172

SCHEMBL336172

NCCCc1ccnc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.67
FERMT2 Q96AC1 1/20 0.51
NCF1 P14598 1/20 0.50
HTR1A P08908 2/20 0.49
ADRA1D P25100 2/20 0.49
ADRA1A P35348 2/20 0.49
ADRA1B P35368 2/20 0.49
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
HIF1A Q16665 1/20 0.43
CYP1A2 P05177 1/20 0.43
TLR8 Q9NR97 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HRH1 P35367 1/20 0.41
NPC1 O15118 1/20 0.40
TP53 P04637 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
SCHEMBL4870416 0.95 LOXL2 (0.65) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL14157416 0.93 LOXL2 (0.62) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL10752255 0.93 LOXL2 (0.62) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL10757258 0.93 LOXL2 (0.62) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL6223283 0.89 LOXL2 (0.71) LOXL2FERMT2NCF1HTR1AADRA1D
Hydrochloric Acid SCHEMBL20592932 0.87 LOXL2 (0.69) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL2333461 0.86 LOXL2 (0.62) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL2331919 0.86 LOXL2 (0.62) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL7599320 0.83 LOXL2 (0.58) LOXL2FERMT2NCF1HTR1AADRA1D
SCHEMBL7358307 0.81 LOXL2 (0.56) LOXL2FERMT2NCF1HTR1AADRA1D

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109415649-A Composition of hydraulic fluid 路博润公司 2019-03-01 CN disclosed
CN-108368358-A improved water separation using quaternary amine additives 路博润公司 2018-08-03 CN disclosed
US-9815863-B2 Hydrogen bond forming fluoro ketolides for treating diseases CEMPRA PHARMACEUTICALS, INC. (US) 2017-11-14 US disclosed
CN-107207889-A For making the polyester dispersants that ceramic tile is coloured using ink jet type ink and ink-jet printer 路博润先进材料公司 2017-09-26 CN disclosed
CN-103649279-B The stabilized mixture that contains friction improver THE LUBRIZOL CORP. (US) 2016-05-04 CN disclosed
EP-2613630-A1 HYDROGEN BOND FORMING FLUORO KETOLIDES FOR TREATING DISEASES Cempra Pharmaceuticals, Inc. (US) 2013-07-17 EP disclosed
US-20130172280-A1 HYDROGEN BOND FORMING FLUORO KETOLIDES FOR TREATING DISEASES CEMPRA PHARMACEUTICALS, INC. (US) 2013-07-04 US disclosed
US-8299035-B2 10a-azalide compound having 4-membered ring structure TAISHO PHARMACEUTUCAL CO., LTD. (JP) 2012-10-30 US disclosed
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 US disclosed
WO-2012034058-A1 HYDROGEN BOND FORMING FLUORO KETOLIDES FOR TREATING DISEASES CEMPRA PHARMACEUTICALS, INC. (US) 2012-03-15 WO disclosed
EP-1568692-A1 (pyridin-4-yl)alkyl-amides as TNF-alpha production inhibitors SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-08-31 EP disclosed
CN-1639181-A Novel 15-membered cyclic azalide, novel 16-membered cyclic diazalide derivative, and process for producing these MEIJI SEIKA KAISHA (JP) 2005-07-13 CN disclosed
CN-1604774-A Angiogenesis inhibitor SANTEN PHARMACEUTICAL CO LTD (JP) 2005-04-06 CN disclosed
CN-1590375-A TNF-alpha prodn. inhibitors SANTEN PHARMACEUTICAL CO LTD (JP) 2005-03-09 CN disclosed
CN-1590374-A TNF-alpha prodn. inhibitors SANTEN PHARMACEUTICAL CO LTD (JP) 2005-03-09 CN disclosed
US-20050014800-A1 Angiogenesis inhibitor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
EP-1479687-A1 NOVEL 15-MEMBERED CYCLIC AZALIDE, NOVEL 16-MEMBERED CYCLIC DIAZALIDE DERIVATIVE, AND PROCESS FOR PRODUCING THESE MEIJI SEIKA KAISHA LTD. (JP) 2004-11-24 EP disclosed
CN-1432000-A TNF-alpha production inhibitors SANTEN PHARMACEUTICAL CO LTD (JP) 2003-07-23 CN disclosed
EP-1302461-A1 TNF-ALPHA PRODUCTION INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2003-04-16 EP disclosed
US-20030032623-A1 Tnf-alpha production inhibitors AYUMI PHARMACEUTICAL CORPORATION (JP) 2003-02-13 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 (3 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-20050014800-A1 Angiogenesis inhibitor FLT4, KDR, FLT1 LOXL2 2581/4885FERMT2 3035/4885NCF1 1212/4885
US-20130172280-A1 HYDROGEN BOND FORMING FLUORO KETOLIDES FOR TREATING DISEASES Q6ZSR9, LSS, LCT LOXL2 1901/4885FERMT2 1527/4885NCF1 2526/4885
US-20030032623-A1 Tnf-alpha production inhibitors TNF, TNFRSF1A, TNFRSF9 LOXL2 2802/4885FERMT2 2282/4885NCF1 134/4885

“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.