SCHEMBL7322864

SCHEMBL7322864

Cc1cc(NC(=O)C2(CN)CCCCC2)ccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 1/20 0.46
SMARCA4 P51532 1/20 0.46
SORT1 Q99523 3/20 0.41
LIMK1 P53667 3/20 0.39
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
PRMT3 O60678 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
LIMK2 P53671 3/20 0.37
ANO1 Q5XXA6 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CETP P11597 1/20 0.37
ROCK2 O75116 1/20 0.37

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
SCHEMBL16568945 0.74 ALDH1A1 (0.55) MEN1KMT2ALMNA
SCHEMBL10209096 0.73 SLC6A2 (0.49) MEN1KMT2ALMNAGAAHDAC1
Hydrochloric Acid SCHEMBL29928336 0.72 LMNA (0.50) PRMT3LMNACETPROCK2ROCK1
SCHEMBL27830970 0.72 OPRM1 (0.47) SMARCA2SMARCA4SORT1MEN1KMT2A
SCHEMBL7328714 0.71 NPC1 (0.46) MEN1KMT2ALMNAMME
SCHEMBL15880595 0.71 SMARCA2 (0.61) SMARCA2SMARCA4SORT1MEN1KMT2A
SCHEMBL15880685 0.70 SMARCA2 (0.65) SMARCA2SMARCA4SORT1MEN1KMT2A
SCHEMBL26050255 0.70 SMARCA2 (0.44) SMARCA2SMARCA4SORT1MEN1KMT2A
SCHEMBL7345225 0.69 PLAU (0.53)
SCHEMBL7672757 0.69 SMARCA2 (0.63) SMARCA2SMARCA4SORT1MEN1KMT2A

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
EP-0370498-A2 Trans-4-amino(alkyl)-1-pyridylcarbamoylcyclohexane compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-05-30 EP claimed