SCHEMBL22918728

SCHEMBL22918728

Nc1cc(OCCN2CCC2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 9/20 0.54
▸ PTGS2 P35354 2/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ CHRNB2 P17787 1/20 0.50
▸ CHRNA4 P43681 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ BACE1 P56817 1/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ PSMB1 P20618 1/20 0.46
▸ PSMB5 P28074 1/20 0.46
▸ PSMB2 P49721 1/20 0.46
▸ NOS3 P29474 1/20 0.46
▸ NOS1 P29475 1/20 0.46
▸ NOS2 P35228 1/20 0.46

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
SCHEMBL29615365 1.00 LTA4H (0.54) LTA4HPTGS2PTGS1CHRNB2CHRNA4
SCHEMBL29615643 0.97 LTA4H (0.57) LTA4HPTGS2PTGS1CHRNB2CHRNA4
SCHEMBL22919001 0.97 LTA4H (0.57) LTA4HPTGS2PTGS1CHRNB2CHRNA4
SCHEMBL22918759 0.89 HRH3 (0.54) KDM4E
SCHEMBL29615450 0.89 HRH3 (0.54) KDM4E
SCHEMBL2023773 0.88 MEN1 (0.55) LTA4HKDM4EALDH1A1SMN1; SMN2KMT2A
SCHEMBL2024990 0.87 KDM4E (0.58) LTA4HKDM4EALDH1A1KMT2A
SCHEMBL29615193 0.87 KDM4E (0.58) LTA4HKDM4EALDH1A1KMT2A
SCHEMBL2029749 0.83 MAOA (0.45) LTA4HKDM4EALDH1A1SMN1; SMN2KMT2A
SCHEMBL22918755 0.81 HRH3 (0.58) KDM4EALDH1A1KMT2ANOS3NOS1

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-20260109697-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2026-04-23 — — US disclosed
US-20220267320-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2022-08-25 — — US disclosed
EP-4003992-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL) -PYRIMIDINE DERIVATIVES Merck Patent GmbH (DE) 2022-06-01 — — EP disclosed
CN-114174293-A 4- (imidazo [1,2-a ] pyridin-3-yl) -pyrimidine derivatives 默克专利股份公司 2022-03-11 — — CN disclosed
WO-2021013864-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL) -PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2021-01-28 — — WO disclosed
WO-2021013864-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL) -PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2021-01-28 — — 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 (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-20260109697-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-PYRIMIDINE DERIVATIVES CHUK, CNKSR1, KIT LTA4H 801/4885PTGS2 83/4885PTGS1 84/4885
US-20220267320-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-PYRIMIDINE DERIVATIVES NCOA3, NCOR1, NCOA4 LTA4H 2162/4885PTGS2 1036/4885PTGS1 698/4885

“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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