SCHEMBL21460002

SCHEMBL21460002

O=C(O)Nc1ccc2c(c1)C(=O)NCC2

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 11/20 0.58
PARP1 P09874 6/20 0.58
F7 P08709 1/20 0.58
F3 P13726 1/20 0.58
PARP11 Q9NR21 7/20 0.47
PDPK1 O15530 1/20 0.47
F11 P03951 3/20 0.44
KLKB1 P03952 3/20 0.44
KDM4E B2RXH2 1/20 0.42
MKNK1 Q9BUB5 1/20 0.41
GSK3B P49841 1/20 0.41
GRM5 P41594 1/20 0.40

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
SCHEMBL11906514 0.87 PARP10 (0.56) PARP10PARP1F7F3PARP11
SCHEMBL28724506 0.84 CLK4 (0.51) MKNK1GSK3B
SCHEMBL25085727 0.80 PARP10 (0.52) PARP10PARP1F7F3PARP11
SCHEMBL2027837 0.80 PARP10 (0.63) PARP10PARP1F7F3PARP11
SCHEMBL17797707 0.79 GSK3B (0.51) PARP10PARP11MKNK1GSK3BGRM5
SCHEMBL3008897 0.77 ROCK2 (0.51) PARP10PARP1F7F3PARP11
SCHEMBL3008902 0.77 ROCK2 (0.51) PARP10PARP1F7F3PARP11
SCHEMBL20894239 0.76 PARP10 (0.58) PARP10PARP1F7F3PARP11
SCHEMBL29631237 0.76 PARP10 (0.58) PARP10PARP1F7F3PARP11
SCHEMBL14395011 0.75 PARP10 (0.61) PARP10PARP1F7F3PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932658-B2 Tricyclic heteroaryl-substituted quinoline and azaquinoline compounds as PAR4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-03-19 US claimed
CN-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN claimed
EP-3484894-B1 TRICYCLIC HETEROARYL-SUBSTITUTED QUINOLINE AND AZAQUINOLINE COMPOUNDS AS PAR4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-08-19 EP claimed
US-11932658-B2 Tricyclic heteroaryl-substituted quinoline and azaquinoline compounds as PAR4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-03-19 US disclosed
CN-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN disclosed
EP-3484894-B1 TRICYCLIC HETEROARYL-SUBSTITUTED QUINOLINE AND AZAQUINOLINE COMPOUNDS AS PAR4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-08-19 EP disclosed
US-20190315774-A1 TRICYCLIC HETEROARYL-SUBSTITUTED QUINOLINE AND AZAQUINOLINE COMPOUNDS AS PAR4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-10-17 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 (2 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-20190315774-A1 TRICYCLIC HETEROARYL-SUBSTITUTED QUINOLINE AND AZAQUINOLINE COMPOUNDS AS PAR4 INHIBITORS F2RL3, PARP14, PF4 PARP10 41/4885PARP1 21/4885F7 58/4885
US-11932658-B2 Tricyclic heteroaryl-substituted quinoline and azaquinoline compounds as PAR4 inhibitors F2RL3, PARP14, F2R PARP10 32/4885PARP1 19/4885F7 120/4885

“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.