SCHEMBL20162174

SCHEMBL20162174

O=C(Nc1cn(Cc2ccc(Cl)cc2)cn1)c1cnc2c(c1)CCNC2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.43
HTR2B P41595 2/20 0.43
TAS2R8 Q9NYW2 1/20 0.41
PTGER1 P34995 3/20 0.40
RIPK1 Q13546 5/20 0.40
SLC2A1 P11166 2/20 0.40
F10 P00742 3/20 0.40
WNT1 P04628 2/20 0.38
GSK3B P49841 2/20 0.38
DYRK1A Q13627 2/20 0.38
CLK2 P49760 1/20 0.38
CLK3 P49761 1/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37

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
SCHEMBL20169996 0.92 HTR2C (0.46) HTR2CHTR2BTAS2R8PTGER1RIPK1
SCHEMBL20162175 0.91 TAS2R8 (0.39) HTR2CHTR2BTAS2R8PTGER1RIPK1
SCHEMBL20162162 0.90 TAS2R8 (0.38) HTR2CHTR2BTAS2R8PTGER1RIPK1
SCHEMBL20162150 0.90 HTR2C (0.46) HTR2CHTR2BTAS2R8RIPK1
SCHEMBL20162143 0.90 TAS2R8 (0.37) HTR2CHTR2BTAS2R8PTGER1RIPK1
SCHEMBL20162155 0.89 TAS2R8 (0.40) TAS2R8PTGER1RIPK1WNT1GSK3B
SCHEMBL20162161 0.88 RIPK1 (0.40) TAS2R8RIPK1
SCHEMBL20162126 0.87 RIPK1 (0.39) TAS2R8RIPK1
SCHEMBL20162116 0.87 TAS2R8 (0.39) TAS2R8PTGER1RIPK1WNT1GSK3B
SCHEMBL20364374 0.87 TAS2R8 (0.44) HTR2CHTR2BTAS2R8RIPK1WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10294237-B2 Bicyclic heterocyclic amide derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-05-21 US claimed
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 US claimed
EP-3323809-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-05-23 EP claimed
US-10294237-B2 Bicyclic heterocyclic amide derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-05-21 US disclosed
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 US disclosed
EP-3323809-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-05-23 EP 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-10294237-B2 Bicyclic heterocyclic amide derivative NR0B1, NR2E1, NR0B2 HTR2C 1471/4885HTR2B 2579/4885TAS2R8 2479/4885
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE NR0B1, NR2E1, NR0B2 HTR2C 1471/4885HTR2B 2579/4885TAS2R8 2479/4885

“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.