SCHEMBL23527095

SCHEMBL23527095

Cn1c(=O)c(C#N)c(N2CCC(Oc3ccc(C#N)cc3)CC2)c2nc(Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 10/20 0.47
▸ DGKA P23743 2/20 0.46
▸ DGKZ Q13574 2/20 0.46
▸ FPR2 P25090 2/20 0.40
▸ PROKR1 Q8TCW9 1/20 0.40
▸ TNKS O95271 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ TNKS2 Q9H2K2 1/20 0.39
▸ KDM1A O60341 1/20 0.38
▸ GPR119 Q8TDV5 2/20 0.38
▸ GPR6 P46095 1/20 0.38
▸ RET P07949 1/20 0.38

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
SCHEMBL31133498 1.00 HRH3 (0.47) HRH3DGKADGKZFPR2PROKR1
SCHEMBL31133650 0.94 DGKA (0.46) HRH3DGKADGKZFPR2PROKR1
SCHEMBL31133750 0.94 DGKA (0.52) HRH3DGKADGKZFPR2PROKR1
SCHEMBL23527176 0.94 DGKA (0.52) HRH3DGKADGKZFPR2PROKR1
SCHEMBL23527307 0.94 DGKA (0.46) HRH3DGKADGKZFPR2PROKR1
SCHEMBL23527004 0.93 DGKA (0.46) HRH3DGKADGKZFPR2PROKR1
SCHEMBL31133736 0.93 DGKA (0.46) HRH3DGKADGKZFPR2PROKR1
SCHEMBL23527042 0.92 DGKA (0.45) HRH3DGKADGKZFPR2PROKR1
SCHEMBL31133628 0.92 DGKA (0.45) HRH3DGKADGKZFPR2PROKR1
SCHEMBL23526862 0.92 DGKA (0.47) HRH3DGKADGKZGPR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4081523-B1 SUBSTITUTED BICYCLIC PIPERIDINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2024-12-25 — — EP claimed
US-11964973-B2 Substituted bicyclic compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-23 — — US claimed
WO-2021133750-A1 SUBSTITUTED BICYCLIC PIPERIDINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-01 — — WO claimed
US-20210188845-A1 SUBSTITUTED BICYCLIC COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY 2021-06-24 — — US claimed
EP-4081523-B1 SUBSTITUTED BICYCLIC PIPERIDINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2024-12-25 — — EP disclosed
US-11964973-B2 Substituted bicyclic compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-23 — — US disclosed
WO-2021133750-A1 SUBSTITUTED BICYCLIC PIPERIDINE DERIVATIVES USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-01 — — WO disclosed
US-20210188845-A1 SUBSTITUTED BICYCLIC COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY 2021-06-24 — — 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-20210188845-A1 SUBSTITUTED BICYCLIC COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKA, DGKZ, DGKK HRH3 917/4885DGKA 1/4885DGKZ 2/4885
US-11964973-B2 Substituted bicyclic compounds useful as T cell activators DGKA, DGKZ, DGKK HRH3 917/4885DGKA 1/4885DGKZ 2/4885

“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.

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