SCHEMBL9469495

SCHEMBL9469495

C=CCN(CCCC)C(=O)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.50
KMT2A Q03164 2/20 0.50
MLYCD O95822 6/20 0.43
HTT P42858 3/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 2/20 0.40
TACR1 P25103 1/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.37
TSHR P16473 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
SCHEMBL8605252 0.86 POLB (0.60) POLBKMT2AMLYCDHTTLMNA
Dimorpholamine SCHEMBL34539 0.85 POLB (0.58) POLBKMT2AMLYCDHTTLMNA
Dimorpholamine SCHEMBL2689742 0.83 POLB (0.57) POLBKMT2AMLYCDHTTLMNA
SCHEMBL12472375 0.76 POLB (0.64) POLBMLYCDHTTLMNASMN1; SMN2
SCHEMBL8605240 0.75 POLB (0.50) POLBKMT2AMLYCDHTTLMNA
SCHEMBL7536659 0.72 HTR1A (0.42) KMT2ATACR1
SCHEMBL12086329 0.72 POLB (0.86) POLBMLYCDHTTLMNASMN1; SMN2
SCHEMBL14919998 0.71 POLB (0.44) POLBKMT2AMLYCDHTTLMNA
SCHEMBL715792 0.70 POLB (0.46) POLBKMT2AMLYCDHTTLMNA
SCHEMBL29206561 0.70 MLYCD (0.50) POLBKMT2AMLYCDHTTLMNA

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
US-5218002-A Morpholinoureas BAYER AKTIENGESELLSCHAFT (DE) 1993-06-08 US claimed