SCHEMBL16634184

SCHEMBL16634184

CC1CN(C(=O)OC(C)(C)C)CC(C(O)c2ccccn2)O1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.44
ADORA2B P29275 5/20 0.44
ADORA2A P29274 4/20 0.44
TP53 P04637 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
GRM5 P41594 2/20 0.39
USP30 Q70CQ3 2/20 0.39
POLB P06746 1/20 0.39
GRM1 Q13255 1/20 0.38
NAMPT P43490 1/20 0.38
IDO1 P14902 1/20 0.37
RORC P51449 1/20 0.37
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 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
SCHEMBL16634183 1.00 GPR119 (0.44) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL16634182 1.00 GPR119 (0.44) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL9948274 0.83 GPR119 (0.50) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL3329455 0.83 GPR119 (0.47) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL3192718 0.83 GPR119 (0.47) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL29215862 0.81 GPR119 (0.48) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL30241585 0.81 GPR119 (0.48) GPR119ADORA2BADORA2ATP53ADORA3
SCHEMBL1328780 0.77 GPR119 (0.60) GPR119ADORA2BADORA2AGRM5USP30
SCHEMBL16633029 0.76 KMT2A (0.47) GPR119NAMPTIDO1RORCPRMT5
SCHEMBL16633025 0.76 KMT2A (0.47) GPR119NAMPTIDO1RORCPRMT5

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
EP-3995495-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2022-05-11 EP disclosed
EP-3626717-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2020-03-25 EP disclosed
US-RE47193-E1 Selectively substituted quinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-01-08 US disclosed
US-20180354939-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-12-13 US disclosed
US-10087174-B2 Selectively substituted quinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-10-02 US disclosed
US-20180030045-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-02-01 US disclosed
US-20160326161-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-11-10 US disclosed
US-9428495-B2 Selectively substituted quinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-08-30 US disclosed
US-20150105370-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-16 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 (5 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-10087174-B2 Selectively substituted quinoline compounds SSB, TLR7, TLR8 GPR119 1787/4885ADORA2B 948/4885ADORA2A 318/4885
US-20180030045-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS SSB, TLR7, TLR8 GPR119 1787/4885ADORA2B 948/4885ADORA2A 318/4885
US-20180354939-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS SSB, TLR7, TLR8 GPR119 1959/4885ADORA2B 1015/4885ADORA2A 410/4885
US-20160326161-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS SSB, TLR7, TLR8 GPR119 1787/4885ADORA2B 948/4885ADORA2A 318/4885
US-20150105370-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS SSB, TLR7, TLR8 GPR119 1787/4885ADORA2B 948/4885ADORA2A 318/4885

“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.