SCHEMBL9936014

SCHEMBL9936014

OCn1cnc2cncnc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.62
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
LTA4H P09960 1/20 0.46
ALDH1A1 P00352 5/20 0.36
CYP1A2 P05177 5/20 0.36
CYP2C19 P33261 5/20 0.36
TSHR P16473 4/20 0.36
CYP3A4 P08684 4/20 0.36
CYP2C9 P11712 4/20 0.36
LMNA P02545 3/20 0.36
MEN1 O00255 1/20 0.36
HBB P68871 1/20 0.36
KMT2A Q03164 1/20 0.36
ADA P00813 1/20 0.36
USP2 O75604 4/20 0.35
ADORA2A P29274 3/20 0.34
ADORA1 P30542 1/20 0.34
DNMT3B Q9UBC3 1/20 0.34
CYP2D6 P10635 2/20 0.33

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
SCHEMBL6259635 0.85 FDPS (0.55) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL30166038 0.85 FDPS (0.55) FDPSHDAC1HDAC6LTA4HALDH1A1
Water SCHEMBL27592739 0.84 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL1797755 0.81 FDPS (0.51) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL29941724 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL28817988 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL5062453 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL10857669 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL6125409 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1
SCHEMBL11200763 0.81 FDPS (0.54) FDPSHDAC1HDAC6LTA4HALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1364838-A Water-thinned Normal temperature hardening fluorosilicious paint with metal texture ZHANG RENTAO (CN) 2002-08-21 CN claimed
CN-1354211-A Water propyl fluorosilicate nano sol weatherability pollution-resisting coating material UNIV SHANGHAI (CN) 2002-06-19 CN claimed
US-20150266839-A1 CYCLIC AMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-09-24 US disclosed
US-20150225392-A1 CYCLIC AMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-08-13 US disclosed
US-9072758-B2 Cyclic amide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-07-07 US disclosed
US-9040525-B2 Cyclic amide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-05-26 US disclosed
US-8765752-B2 3-hydroxyisothiazole 1-oxide derivatives MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2014-07-01 US disclosed
EP-2703394-A1 NOVEL 3-HYDROXYISOTHIAZOLE 1-OXIDE DERIVATIVE Mochida Pharmaceutical Co., Ltd. (JP) 2014-03-05 EP disclosed
EP-2703393-A1 CYCLIC AMIDE DERIVATIVE Mochida Pharmaceutical Co., Ltd. (JP) 2014-03-05 EP disclosed
US-20140057871-A1 CYCLIC AMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2014-02-27 US disclosed
US-8629102-B2 3-hydroxyisothiazole 1-oxide derivatives MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2014-01-14 US disclosed
US-8455500-B2 3-hydroxy-5-arylisoxazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-06-04 US disclosed
CN-102901790-A Determination method of urine metabolic marker for early diagnosis of diabetic nephropathy. NANJING GEN HOSP COMMAND PLA 2013-01-30 CN disclosed
US-20120277150-A1 NOVEL 3-HYDROXYISOTHIAZOLE 1-OXIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-11-01 US disclosed
EP-2518060-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE Mochida Pharmaceutical Co., Ltd. (JP) 2012-10-31 EP disclosed
EP-2495238-A1 NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE Mochida Pharmaceutical Co., Ltd. (JP) 2012-09-05 EP disclosed
US-20120220772-A1 NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-08-30 US disclosed
US-20120157459-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-06-21 US disclosed
CN-1364838-A Water-thinned Normal temperature hardening fluorosilicious paint with metal texture ZHANG RENTAO (CN) 2002-08-21 CN disclosed
CN-1354211-A Water propyl fluorosilicate nano sol weatherability pollution-resisting coating material UNIV SHANGHAI (CN) 2002-06-19 CN 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 (6 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-20150266839-A1 CYCLIC AMIDE DERIVATIVE GPR119, NR0B1, NR4A1 FDPS 4203/4885HDAC1 715/4885HDAC6 3152/4885
US-20140057871-A1 CYCLIC AMIDE DERIVATIVE GPR119, NR0B1, NR4A1 FDPS 4255/4885HDAC1 637/4885HDAC6 3139/4885
US-20150225392-A1 CYCLIC AMIDE DERIVATIVE GPR119, NR0B1, NR2C2 FDPS 4189/4885HDAC1 344/4885HDAC6 1982/4885
US-20120157459-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE GPR119, GPR27, NR0B1 FDPS 4383/4885HDAC1 935/4885HDAC6 2282/4885
US-20120220772-A1 NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE GPR119, GPR27, NR0B1 FDPS 3935/4885HDAC1 739/4885HDAC6 2156/4885
US-20120277150-A1 NOVEL 3-HYDROXYISOTHIAZOLE 1-OXIDE DERIVATIVE GPR119, GPR27, GPR65 FDPS 4552/4885HDAC1 637/4885HDAC6 1642/4885

“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.