SCHEMBL22280559

SCHEMBL22280559

CC(C)(C)OC(=O)N1CCC(c2nc(-c3ccc(Nc4cccc(C(C)(C)C)c4)nc3)no2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
TUBB4A P04350 2/20 0.43
TUBB P07437 2/20 0.43
TUBA3C P0DPH7 2/20 0.43
TUBA1B P68363 2/20 0.43
TUBA4A P68366 2/20 0.43
TUBB4B P68371 2/20 0.43
TUBB3 Q13509 2/20 0.43
TUBB2A Q13885 2/20 0.43
TUBB8 Q3ZCM7 2/20 0.43
TUBA3E Q6PEY2 2/20 0.43
TUBA1A Q71U36 2/20 0.43
TUBA1C Q9BQE3 2/20 0.43
TUBB6 Q9BUF5 2/20 0.43

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
SCHEMBL29523141 1.00 LMNA (0.47) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22265631 0.91 LMNA (0.49) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22265627 0.91 LMNA (0.49) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22280553 0.88 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22265596 0.88 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22265592 0.88 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22265599 0.88 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL29523344 0.88 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22280535 0.87 LMNA (0.45) LMNAHTTSMN1; SMN2MEN1MAPT
SCHEMBL22280307 0.87 MAPK1 (0.50) LMNAHTTSMN1; SMN2MAPTTUBB4A

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
WO-2020154431-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY LYNCH KEVIN R (US) 2020-07-30 WO disclosed