SCHEMBL13835200

SCHEMBL13835200

NC(N)=Nc1cccc2c1P(=O)(O)Oc1ccccc1-2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.37
HTR3B O95264 2/20 0.37
HTR3A P46098 2/20 0.37
HTR3D Q70Z44 2/20 0.37
HTR3C Q8WXA8 2/20 0.37
PLAU P00749 2/20 0.36
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
RAD52 P43351 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
SLC22A2 O15244 1/20 0.30
SLC22A1 O15245 1/20 0.30
SLC22A3 O75751 1/20 0.30

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
SCHEMBL10324852 0.83 HTR3E (0.37) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL13278323 0.77 ALDH1A1 (0.34)
SCHEMBL2437037 0.74 MYC (0.38)
SCHEMBL9355805 0.74 GPR84 (0.31)
Guanidine SCHEMBL13835198 0.68 GPR84 (0.33)
SCHEMBL2436265 0.68 GPR84 (0.35) PKM
SCHEMBL29519147 0.68 GPR84 (0.35) PKM
SCHEMBL18076604 0.67 KDM4E (0.36) PKM
SCHEMBL30426151 0.66 GPR84 (0.52) PKM
SCHEMBL887277 0.66 GPR84 (0.52) PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035892-B2 Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2018-07-31 US claimed
US-20170044342-A1 FLAME-RETARDANT EXPANDABLE POLYMERS SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2017-02-16 US claimed
US-20140128489-A1 Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2014-05-08 US claimed
CN-103608388-A Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GMBH 2014-02-26 CN claimed
US-20120292582-A1 AMMONIUM SALTS OF 9,10-DIHYDRO-10-HYDROXY-9-OXA-10-PHOSPHA-PHENANTHRENE-10-ONE KREMS CHEMIE CHEMICAL SERVICES AG (AT) 2012-11-22 US claimed
US-10035892-B2 Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2018-07-31 US disclosed
US-20170044342-A1 FLAME-RETARDANT EXPANDABLE POLYMERS SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2017-02-16 US disclosed
US-20140128489-A1 Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GESELLSCHAFT M.B.H. (AT) 2014-05-08 US disclosed
CN-103608388-A Flame-retardant expandable polymers SUNPOR KUNSTSTOFF GMBH 2014-02-26 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 (2 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-10035892-B2 Flame-retardant expandable polymers PFAS, PHOSPHO1, DHODH HTR3E 2705/4885HTR3B 3326/4885HTR3A 2110/4885
US-20120292582-A1 AMMONIUM SALTS OF 9,10-DIHYDRO-10-HYDROXY-9-OXA-10-PHOSPHA-PHENANTHRENE-10-ONE DAO, NUDT1, AOC1 HTR3E 2074/4885HTR3B 1395/4885HTR3A 681/4885

“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.