SCHEMBL19584510

SCHEMBL19584510

CC(C)(C)[Si](C)(C)OCC#Cc1cccc(N)n1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 16/20 0.39
▸ NOS3 P29474 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ ALK Q9UM73 1/20 0.31
▸ IDH1 O75874 1/20 0.31

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
SCHEMBL24618194 0.80 GRM5 (0.36) GRM5ALK
SCHEMBL617257 0.75 ALOX5AP (0.35) —
SCHEMBL20973025 0.75 — —
SCHEMBL14207818 0.73 GRM5 (0.42) GRM5NOS3NOS2
SCHEMBL3534071 0.72 NOS2 (0.38) NOS3NOS2IDH1
SCHEMBL8526099 0.72 CYP1A2 (0.41) ALK
SCHEMBL31607907 0.71 CYP1A2 (0.38) —
SCHEMBL26100624 0.71 RET (0.32) —
SCHEMBL30392633 0.71 RET (0.32) —
SCHEMBL19062737 0.70 GRM5 (0.39) GRM5NOS3NOS2

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
EP-3455212-B1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 HEPTARES THERAPEUTICS LTD (GB) 2022-02-09 — — EP disclosed
US-10995072-B2 Inhibitors of protease-activated receptor-2 HEPTARES THERAPEUTICS LIMITED (GB) 2021-05-04 — — US disclosed
US-20200140392-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 NXERA PHARMA UK LIMITED (GB) 2020-05-07 — — US disclosed
US-10550089-B2 Inhibitors of protease-activated receptor-2 HEPTARES THERAPEUTICS LIMITED (GB) 2020-02-04 — — US disclosed
US-20190144394-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 HEPTARES THERAPEUTICS LIMITED (GB) 2019-05-16 — — US disclosed
EP-3455212-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 Heptares Therapeutics Limited (GB) 2019-03-20 — — EP disclosed
WO-2017194716-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 ASTRAZENECA AB (SE) 2017-11-16 — — 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 (4 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-10550089-B2 Inhibitors of protease-activated receptor-2 F2RL1, F2R, F2RL3 GRM5 1023/4885NOS3 1195/4885NOS2 1128/4885
US-20190144394-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 F2RL1, F2R, F2RL3 GRM5 1023/4885NOS3 1195/4885NOS2 1128/4885
US-10995072-B2 Inhibitors of protease-activated receptor-2 F2RL1, F2R, F2RL3 GRM5 1013/4885NOS3 2676/4885NOS2 1328/4885
US-20200140392-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 F2RL1, F2R, F2RL3 GRM5 1013/4885NOS3 2676/4885NOS2 1328/4885

“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.

Send feedback