SCHEMBL21060469

SCHEMBL21060469

CC(C)(C)OC(=O)N1CC=C(c2ncc(N)cc2F)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 10/20 0.55
GRM5 P41594 9/20 0.55
TNK2 Q07912 2/20 0.49
CYP11B2 P19099 1/20 0.47
CDK9 P50750 2/20 0.46
ATR Q13535 2/20 0.46
PDK4 Q16654 1/20 0.45
CCNT1 O60563 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
BTK Q06187 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
SCHEMBL30675208 1.00 GRM1 (0.55) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL15168000 0.90 TNK2 (0.50) GRM1GRM5TNK2CYP11B2ATR
SCHEMBL22328950 0.89 GRM1 (0.57) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL31583898 0.87 GRM1 (0.55) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL23705785 0.86 GRM5 (0.57) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL1463273 0.85 GRM1 (0.51) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL27167796 0.83 GRM1 (0.52) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL31700785 0.83 GRM1 (0.52) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL29976826 0.83 GRM1 (0.52) GRM1GRM5TNK2CYP11B2CDK9
SCHEMBL6396667 0.83 PDK4 (0.52) GRM1GRM5TNK2CYP11B2CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025106910-A1 DEGRADER MOLECULES TARGETING ANDROGEN RECEPTOR FLARE THERAPEUTICS INC. (US) 2025-05-22 WO disclosed
US-11820768-B2 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-21 US disclosed
US-11820768-B2 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-21 US disclosed
US-11820768-B2 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-21 US disclosed
EP-3728252-B1 4-AZAINDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-08-09 EP disclosed
EP-3728252-B1 4-AZAINDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-08-09 EP disclosed
US-20220340555-A1 4-AZAINDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2022-10-27 US disclosed
US-11053244-B1 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-06 US disclosed
US-11053244-B1 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-06 US disclosed
US-10730877-B2 4-Azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2020-08-04 US disclosed
US-10730877-B2 4-Azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2020-08-04 US disclosed
US-20200095247-A1 4-AZAINDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-03-26 US disclosed
US-20200095247-A1 4-AZAINDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-03-26 US disclosed
US-10544143-B2 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2020-01-28 US disclosed
US-10544143-B2 4-azaindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2020-01-28 US disclosed
US-20190185469-A1 4-AZAINDOLE COMPOUNDS SYNGENE INTERNATIONAL LIMITED (IN) 2019-06-20 US disclosed
US-20190185469-A1 4-AZAINDOLE COMPOUNDS SYNGENE INTERNATIONAL LIMITED (IN) 2019-06-20 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 (7 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-11820768-B2 4-azaindole compounds TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-20220340555-A1 4-AZAINDOLE COMPOUNDS TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-11053244-B1 4-azaindole compounds TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-10544143-B2 4-azaindole compounds TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-10730877-B2 4-Azaindole compounds TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-20190185469-A1 4-AZAINDOLE COMPOUNDS TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885
US-20200095247-A1 4-AZAINDOLE COMPOUNDS TLR7, TLR9, TLR5 GRM1 117/4885GRM5 58/4885TNK2 448/4885

“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.