SCHEMBL23245940

SCHEMBL23245940

CN(C)C=CC(=O)c1cnc2ccc(Br)cn12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.49
▸ RECQL P46063 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ ADORA2A P29274 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ POLB P06746 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MTOR P42345 1/20 0.36

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
SCHEMBL23245988 1.00 RAB9A (0.49) RAB9ARECQLLMNAADORA2AALDH1A1
SCHEMBL23245937 1.00 RAB9A (0.49) RAB9ARECQLLMNAADORA2AALDH1A1
SCHEMBL29883915 0.85 CYP1A2 (0.43) RAB9ARECQLLMNAALDH1A1KDM4E
SCHEMBL28718664 0.85 CYP1A2 (0.43) RAB9ARECQLLMNAALDH1A1KDM4E
SCHEMBL29885142 0.84 MAPT (0.49) RAB9ARECQLLMNAALDH1A1KDM4E
SCHEMBL22876522 0.84 HTT (0.39) RAB9ARECQLLMNAALDH1A1KDM4E
SCHEMBL23245952 0.84 CYP1A2 (0.49) RECQLADORA2AALDH1A1HTTMAPT
SCHEMBL23245919 0.84 MAPT (0.49) RAB9ARECQLLMNAALDH1A1KDM4E
SCHEMBL29544498 0.81 GAA (0.47) LMNAALDH1A1KDM4EKMT2APOLB
SCHEMBL3546699 0.78 NPC1 (0.49) RAB9ARECQLLMNAADORA2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4045506-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS Aucentra Therapeutics Pty Ltd (AU) 2022-08-24 — — EP disclosed
WO-2021072475-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS AUCENTRA THERAPEUTICS PTY LTD (AU) 2021-04-22 — — WO disclosed
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