SCHEMBL6159637

SCHEMBL6159637

CC(C)(C)OC(=O)N1CCN(c2ccccc2C(N)=O)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.57
PARP1 P09874 1/20 0.54
SMARCA2 P51531 1/20 0.52
SMARCA4 P51532 1/20 0.52
PBRM1 Q86U86 1/20 0.52
GPR119 Q8TDV5 2/20 0.50
POLB P06746 1/20 0.50
CKS1B P61024 2/20 0.49
SKP1 P63208 2/20 0.49
SKP2 Q13309 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
BACE1 P56817 1/20 0.48
PTPN11 Q06124 1/20 0.48
NAMPT P43490 1/20 0.48
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KIT P10721 1/20 0.47
CHRM2 P08172 1/20 0.46

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
SCHEMBL2327346 0.87 GPR119 (0.51) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL110679 0.87 GPR119 (0.54) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL20516451 0.87 PARP1 (0.53) PARP1SMARCA2SMARCA4PBRM1GPR119
SCHEMBL26054717 0.86 GPR119 (0.50) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL7352143 0.85 KMT2A (0.52) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL6158237 0.84 GPR119 (0.48) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL21360304 0.84 BACE1 (0.54) SMARCA2SMARCA4PBRM1GPR119POLB
SCHEMBL2843440 0.83 SMARCA2 (0.60) SMARCA2SMARCA4PBRM1GPR119CKS1B
SCHEMBL29664457 0.83 SMARCA2 (0.60) SMARCA2SMARCA4PBRM1GPR119CKS1B
SCHEMBL29664453 0.83 SMARCA2 (0.60) SMARCA2SMARCA4PBRM1GPR119CKS1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937715-B1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA (JP) 2005-06-01 EP disclosed
US-6355642-B1 PSYCHOLOGICAL DISORDERS AND BRAIN DISORDERS MEIJI SEIKA KAISHA, LTD. (JP) 2002-03-12 US disclosed
EP-0937715-A1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1999-08-25 EP disclosed