SCHEMBL27212640

SCHEMBL27212640

CC(CC(C)C)=NNC(=O)c1cc(Cl)ccn1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.53
▸ GAA P10253 7/20 0.48
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ MAPT P10636 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ANO1 Q5XXA6 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ AGTR1 P30556 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL24835694 0.83 RAB9A (0.60) GAARAB9ANPC1HTTMAPT
SCHEMBL30777268 0.83 RAB9A (0.60) GAARAB9ANPC1HTTMAPT
SCHEMBL27212643 0.82 GAA (0.47) GAARAB9AHTTMAPTALDH1A1
SCHEMBL12010974 0.75 GAA (0.45) GAARAB9ANPC1HTTMAPT
SCHEMBL2677478 0.75 KDM4C (0.57) KDM4CRAB9ANPC1MAPTL3MBTL1
SCHEMBL178048 0.73 KDM4C (0.75) KDM4CRAB9ANPC1MAPTL3MBTL1
SCHEMBL15743827 0.72 KDM4C (0.78) KDM4CRAB9ANPC1MAPTL3MBTL1
SCHEMBL2995777 0.72 KDM4E (0.56) GAARAB9AHTTMAPTALDH1A1
SCHEMBL2995779 0.72 KDM4E (0.56) GAARAB9AHTTMAPTALDH1A1
SCHEMBL12720811 0.72 AGTR1 (0.58) GAARAB9ANPC1HTTMAPT

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
US-20240317978-A1 RUBBER COMPOSITION AND TIRE OTSUKA CHEMICAL CO., LTD. (JP) 2024-09-26 — — US disclosed
EP-4365229-A1 RUBBER COMPOSITION AND TIRE Otsuka Chemical Co., Ltd. (JP) 2024-05-08 — — EP disclosed
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