SCHEMBL22470569

SCHEMBL22470569

Nc1nc2ccc(-c3cncc(C(=O)O)c3)cc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 16/20 0.60
PI4KB Q9UBF8 16/20 0.60
PIK3CA P42336 15/20 0.60
PIK3CD O00329 14/20 0.60
PIK3CG P48736 12/20 0.60
PIK3CB P42338 12/20 0.60
PIP5K1C O60331 6/20 0.58
MKNK1 Q9BUB5 1/20 0.52
MKNK2 Q9HBH9 1/20 0.52
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
MITF O75030 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
NFKB1 P19838 1/20 0.50
RECQL P46063 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL29714022 1.00 PI4KA (0.60) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL22470617 0.85 PIK3CA (0.59) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL22470570 0.80 PI4KA (0.52) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL3713842 0.79 PI4KA (0.58) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL25303323 0.78 PI4KA (0.72) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL211024 0.78 RAB9A (0.66) PI4KAPI4KBPIK3CAKDM4ENPC1
SCHEMBL3713839 0.78 PIK3CA (0.54) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL22470789 0.78 PI4KA (0.57) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL12543471 0.78 PI4KA (0.66) PI4KAPI4KBPIK3CAPIK3CDPIK3CG
SCHEMBL29646253 0.78 PIK3CA (0.82) PI4KAPI4KBPIK3CAPIK3CDPIK3CG

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-20220177462-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-06-09 US disclosed
US-20220177462-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-06-09 US disclosed
EP-3943488-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2022-01-26 EP disclosed
EP-3943488-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2022-01-26 EP disclosed
WO-2020192562-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 劲方医药科技(上海)有限公司 2020-10-01 WO disclosed
WO-2020192562-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 劲方医药科技(上海)有限公司 2020-10-01 WO 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-20220177462-A1 SUBSTITUTED HETEROCYCLIC AMIDE COMPOUND AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF RIPK1, RIPK4, RIPK3 PI4KA 291/4885PI4KB 416/4885PIK3CA 289/4885

“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.