SCHEMBL29544286

SCHEMBL29544286

N=C(N)Nc1ccc(N2CCOCC2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ DGAT1 O75907 1/20 0.47
▸ TYK2 P29597 2/20 0.46
▸ JAK2 O60674 1/20 0.46
▸ JAK1 P23458 1/20 0.46
▸ JAK3 P52333 1/20 0.46
▸ PCSK9 Q8NBP7 1/20 0.45
▸ MAPT P10636 7/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ CCND3 P30281 2/20 0.43
▸ CDK6 Q00534 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ CDK4 P11802 2/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ AKR1C3 P42330 1/20 0.43
▸ EP300 Q09472 1/20 0.42
▸ CCNK O75909 1/20 0.42

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
SCHEMBL28717895 1.00 POLB (0.47) POLBDGAT1TYK2JAK2JAK1
Hydrochloric Acid SCHEMBL4249740 0.99 DGAT1 (0.46) POLBDGAT1TYK2JAK2JAK1
Trifluoroacetic Acid SCHEMBL18453971 0.89 JAK2 (0.48) POLBDGAT1TYK2JAK2JAK1
Trifluoroacetic Acid SCHEMBL18453954 0.89 JAK2 (0.48) POLBDGAT1TYK2JAK2JAK1
SCHEMBL18453953 0.85 MAPT (0.44) POLBMAPTSMN1; SMN2RAB9AALDH1A1
SCHEMBL29389581 0.82 FLT3 (0.47) MAPTALDH1A1CCND3CDK6CDK4
SCHEMBL28937063 0.82 FLT3 (0.47) MAPTALDH1A1CCND3CDK6CDK4
SCHEMBL4246373 0.82 CHRNB2 (0.53) CCND3CDK6CDK4CCNA2CDK2
SCHEMBL12952691 0.81 POLB (0.51) POLBDGAT1TYK2JAK2JAK1
SCHEMBL25949364 0.81 POLB (0.51) POLBDGAT1TYK2JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269742-B Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridinyl) pyrimidin-2-amine as therapeutic agents 常州千红生化制药股份有限公司 2024-07-16 — — CN disclosed
EP-3997088-A1 DERIVATIVES OF 4-(IMIDAZO[L,2-A]PYRIDIN-3-YL)-N-(PYRIDINYL)PYRIMIDIN- 2-AMINE AS THERAPEUTIC AGENTS Aucentra Therapeutics Pty Ltd (AU) 2022-05-18 — — EP disclosed
CN-114269742-A Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridinyl) pyrimidin-2-amines as therapeutic agents 常州千红生化制药股份有限公司 2022-04-01 — — CN disclosed
Send feedback