SCHEMBL19829015

SCHEMBL19829015

c1cc(N2CCOCC2)c2cccnc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.57
NCF1 P14598 3/20 0.53
ADRB2 P07550 1/20 0.53
PTK2 Q05397 1/20 0.53
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
PLK4 O00444 1/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 2/20 0.46
SLC40A1 Q9NP59 1/20 0.46
KCNH2 Q12809 1/20 0.46
PIK3CA P42336 2/20 0.46
PIK3CD O00329 1/20 0.46
PIK3CB P42338 1/20 0.46
POLB P06746 2/20 0.45
HTR1A P08908 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ATR Q13535 1/20 0.43

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
SCHEMBL3836532 0.89 NCF1 (0.67) METAP1NCF1ADRB2PTK2ALOX15
SCHEMBL30307430 0.89 NCF1 (0.67) METAP1NCF1ADRB2PTK2ALOX15
SCHEMBL30659482 0.81 ADRB2 (0.47) METAP1NCF1ADRB2KDM4EKCNH2
SCHEMBL2884262 0.81 NCF1 (0.79) NCF1ADRB2MAPTKDM4EHTR1A
SCHEMBL30604063 0.80 METAP1 (0.47) METAP1NCF1PTK2ALOX15MAPK1
SCHEMBL7957352 0.79 ADRB2 (0.51) NCF1ADRB2MAPTKDM4EKCNH2
Hydrochloric Acid SCHEMBL3711412 0.79 NCF1 (0.77) NCF1ADRB2MAPTKDM4EHTR1A
SCHEMBL30659356 0.78 ADRB2 (0.50) NCF1ADRB2MAPTKDM4EKCNH2
SCHEMBL22050038 0.77 PTK2 (0.65) METAP1PTK2ALOX15MAPK1MAPT
SCHEMBL13987031 0.77 NR4A1 (0.55) NCF1ADRB2MAPTKCNH2HTR1A

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
US-RE47193-E1 Selectively substituted quinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-01-08 US disclosed
US-20180030045-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-02-01 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-20180030045-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS SSB, TLR7, TLR8 METAP1 2835/4885NCF1 413/4885ADRB2 1658/4885

“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.