SCHEMBL352886

SCHEMBL352886

CNC(=O)c1c(-c2ccccc2)noc1C

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.68
HTT P42858 1/20 0.68
GAA P10253 2/20 0.68
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
MAPK1 P28482 2/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
ALDH1A1 P00352 4/20 0.65
L3MBTL1 Q9Y468 2/20 0.62
ALOX12 P18054 1/20 0.62
KDM4E B2RXH2 1/20 0.62
POLB P06746 1/20 0.60
TP53 P04637 1/20 0.60

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
SCHEMBL11413225 0.88 TSHR (0.53) TSHRHTTGAAMEN1KMT2A
SCHEMBL976467 0.88 TSHR (0.68) TSHRHTTGAAMEN1KMT2A
SCHEMBL9409750 0.86 ALDH1A1 (0.57) TSHRHTTGAAMEN1KMT2A
SCHEMBL1930296 0.86 MEN1 (0.70) TSHRHTTGAAMEN1KMT2A
SCHEMBL11419174 0.85 GPBAR1 (0.61) TSHRHTTMEN1KMT2AALDH1A1
SCHEMBL8408128 0.85 ALDH1A1 (0.60) TSHRHTTGAAMEN1KMT2A
SCHEMBL5533585 0.84 L3MBTL1 (0.69) TSHRHTTGAAMEN1KMT2A
SCHEMBL13501824 0.84 KMT2A (0.69) TSHRHTTGAAMEN1KMT2A
SCHEMBL316093 0.83 KMT2A (0.76) TSHRHTTGAAMEN1KMT2A
SCHEMBL27722453 0.83 KMT2A (0.76) TSHRHTTGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES IPS HEART 2021-02-25 US disclosed
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US disclosed
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US disclosed
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2010-05-06 US disclosed
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds RANBAXY LABORATORIES LIMITED INC. (IN) 2010-05-06 US disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-4124714-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS, NEUROLEPTICS, ANTIULCER AGENTS SANDOZ, INC. (US) 1978-11-07 US disclosed
US-4122182-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS, NEUROLEPTICS SANDOZ, INC. (US) 1978-10-24 US disclosed
US-4113727-A Process for the preparation of substituted isoxazolo[4,5-c]pyridin-4-(5H)-ones SANDOZ, INC. (US) 1978-09-12 US disclosed
US-4103013-A TRANQUILIZERS, SLEEP INDUCERS SANDOZ, INC. (US) 1978-07-25 US disclosed
US-4086421-A HYPOLIPIDEMIC AGENTS SANDOZ, INC. (US) 1978-04-25 US disclosed
US-4064251-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS SANDOZ, INC. (US) 1977-12-20 US disclosed
US-4060533-A ANTIALLERGY SANDOZ, INC. (US) 1977-11-29 US disclosed
US-4054653-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS SANDOZ, INC. (US) 1977-10-18 US disclosed
US-4049813-A HYPOLIPIDEMIC AGENTS SANDOZ, INC. (US) 1977-09-20 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 (4 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-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS EXOSC9, EXOSC5, EXOSC4 TSHR 4432/4885HTT 601/4885GAA 562/4885
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA TSHR 2748/4885HTT 1843/4885GAA 602/4885
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES EXOSC5, UTRN, EXOSC4 TSHR 2565/4885HTT 2106/4885GAA 3034/4885
US-20100113371-A9 Derivatives Of Pentose Monosaccharides As Anti-Inflammatory Compounds HLA-DRB1, IL5, TNF TSHR 3110/4885HTT 2777/4885GAA 962/4885

“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.