SCHEMBL31492990

SCHEMBL31492990

CN(C)CCOc1cnc(Br)cc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.45
▸ ALDH1A1 P00352 9/20 0.45
▸ LMNA P02545 2/20 0.45
▸ HTR7 P34969 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ GAA P10253 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SYK P43405 1/20 0.39

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
SCHEMBL31492972 0.82 TSHR (0.41) KDM4EALDH1A1
SCHEMBL23535454 0.80 TSHR (0.60) KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL30427170 0.80 TSHR (0.60) KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL27040855 0.78 KDM4E (0.58) KDM4EALDH1A1LMNAHTR7SMN1; SMN2
SCHEMBL31078644 0.77 CHRNB2 (0.48) KDM4EALDH1A1HTR7SMN1; SMN2TDP1
SCHEMBL23861156 0.77 KDM4E (0.55) KDM4EALDH1A1LMNAHTR7SMN1; SMN2
SCHEMBL16333723 0.76 LCK (0.55) KDM4EALDH1A1TDP1
SCHEMBL31493111 0.76 HSD17B10 (0.41) KDM4EALDH1A1GAA
SCHEMBL1974546 0.76 KDM4E (0.44) KDM4EALDH1A1LMNAHTR7SMN1; SMN2
SCHEMBL25155338 0.75 ALDH1A1 (0.47) KDM4EALDH1A1LMNAHTR7SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119894879-A Tyrosine kinase 2 inhibitors and uses thereof 渤健马萨诸塞州股份有限公司 2025-04-25 — — CN disclosed
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