SCHEMBL13617231

SCHEMBL13617231

Ic1ccc2c(c1)CCOC2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 6/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
TDP2 O95551 2/20 0.34
HTR6 P50406 2/20 0.32

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
SCHEMBL9119279 0.92 PNMT (0.46) PNMTADRA2AADRA2BADRA2CTDP2
SCHEMBL10238388 0.82 PNMT (0.42) PNMTADRA2AADRA2BADRA2CTDP2
SCHEMBL3982958 0.75 MAPT (0.40) HTR6
SCHEMBL10253943 0.75 HTR2A (0.48) PNMTADRA2AADRA2BADRA2CHTR6
SCHEMBL3499450 0.75 METAP1 (0.35) ADRA2AHTR6
SCHEMBL6988847 0.75 DRD2 (0.44)
SCHEMBL19835515 0.75 CA1 (0.39) HTR6
SCHEMBL5366924 0.75 ASIC3 (0.46) PNMTADRA2AADRA2BADRA2CTDP2
SCHEMBL31122821 0.74 PNMT (0.58) PNMTADRA2AADRA2BADRA2CTDP2
SCHEMBL18454733 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014086316-A1 SUBSTITUTED PYRIDOPYRAZINES AS SYK INHIBITORS HUTCHISON MEDIPHARMA LIMITED (CN) 2014-06-12 WO disclosed
US-20090281081-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-11-12 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 (1 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-20090281081-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR ACKR3, CCL11, CCR7 PNMT 3406/4885ADRA2A 1326/4885ADRA2B 1114/4885

“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.