SCHEMBL23219207

SCHEMBL23219207

CCOC(=O)Cc1ccccc1OCc1nn(C(C)C)c2ccc(-c3ccc(CN)cc3)cc12

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CFD P00746 10/20 0.55
TPSB2 P20231 7/20 0.41
F11 P03951 6/20 0.41
PLG P00747 1/20 0.41
PLAU P00749 1/20 0.41
KLKB1 P03952 1/20 0.41
F7 P08709 1/20 0.41
TBXAS1 P24557 1/20 0.39
DPP4 P27487 2/20 0.37
ICMT O60725 3/20 0.36
SYK P43405 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
AHR P35869 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 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
SCHEMBL29852913 1.00 CFD (0.55) CFDTPSB2F11PLGPLAU
SCHEMBL23219243 0.95 CFD (0.62) CFDTPSB2F11PLGPLAU
SCHEMBL29853182 0.95 CFD (0.62) CFDTPSB2F11PLGPLAU
SCHEMBL29852792 0.92 CFD (0.52) CFDTPSB2F11PLGPLAU
SCHEMBL23218809 0.92 CFD (0.52) CFDTPSB2F11PLGPLAU
SCHEMBL23219007 0.92 CFD (0.47) CFDTPSB2F11PLGPLAU
SCHEMBL29852422 0.92 CFD (0.47) CFDTPSB2F11PLGPLAU
SCHEMBL23219123 0.90 CFD (0.48) CFDTPSB2F11PLGPLAU
SCHEMBL29852977 0.90 CFD (0.48) CFDTPSB2F11PLGPLAU
SCHEMBL23218752 0.90 CFD (0.49) CFDTPSB2F11PLGPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114502168-A Oral complement factor D inhibitors 拜奥克里斯特制药公司 2022-05-13 CN disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
US-20160361275-A1 SUBSTITUTED PHENETHYLAMINES WITH SEROTONINERGIC AND/OR NOREPINEPHRINERGIC ACTIVITY ACADIA PHARMACEUTICALS INC. 2016-12-15 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-20160361275-A1 SUBSTITUTED PHENETHYLAMINES WITH SEROTONINERGIC AND/OR NOREPINEPHRINERGIC ACTIVITY SLC6A4, HTR4, GPR34 CFD 4300/4885TPSB2 1052/4885F11 3972/4885

“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.