SCHEMBL21565355

SCHEMBL21565355

CC(C)(Br)CC(C)(C)C1CCC(=O)N1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RAB9A P51151 1/20 0.31
POLB P06746 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL14415910 0.79 LMNA (0.33) LMNAALDH1A1SMN1; SMN2
SCHEMBL19144013 0.78 LMNA (0.34) LMNAALDH1A1SMN1; SMN2POLB
SCHEMBL22023888 0.76 CRBN (0.32) LMNA
SCHEMBL18686236 0.75 ALDH1A1 (0.33) LMNAALDH1A1SMN1; SMN2RAB9ATDP1
SCHEMBL14916972 0.74 ALDH1A1 (0.34) LMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL11917928 0.74 ALDH1A1 (0.34) LMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL7946755 0.74 ALDH1A1 (0.34) LMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL21191593 0.71 CCR2 (0.36) ALDH1A1POLB
SCHEMBL16097469 0.71 LMNA (0.37) LMNAALDH1A1SMN1; SMN2POLBTDP1
SCHEMBL16097473 0.71 LMNA (0.37) LMNAALDH1A1SMN1; SMN2POLBTDP1

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-2019217890-A1 NOVEL FUNCTIONALIZED LACTAMS AS MODULATORS OF THE 5-HYDROXYTRYPTAMINE RECEPTOR 7 AND THEIR METHOD OF USE TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2019-11-14 WO disclosed