Urethane

Urethane

SCHEMBL28839463

CCOC(N)=O.OC1c2ccccc2Oc2ccccc21

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
POLB P06746 1/20 0.52
ATM Q13315 2/20 0.51
KMT2A Q03164 6/20 0.48
MEN1 O00255 4/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 2/20 0.46
ALOX15 P16050 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP2D6 P10635 1/20 0.45
CHRM1 P11229 1/20 0.45
KCNH2 Q12809 1/20 0.45
NPC1 O15118 1/20 0.44
MAPT P10636 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
Urethane SCHEMBL28298474 0.85 ALOX15 (0.58) POLBATMKMT2AMEN1USP2
SCHEMBL595243 0.78 ATM (0.69) POLBATMKMT2AMEN1USP2
SCHEMBL8646639 0.77 POLB (0.51) MAOAMAOBPOLBKMT2AMEN1
SCHEMBL20545618 0.76 ATM (0.55) MAOAMAOBPOLBATMKMT2A
SCHEMBL521775 0.76 MAOA (1.00) MAOAMAOBATMKMT2AMEN1
SCHEMBL29419966 0.76 MAOA (1.00) MAOAMAOBATMKMT2AMEN1
SCHEMBL9239391 0.75 MAOA (0.45) MAOAMAOBPOLBATMKMT2A
Urethane SCHEMBL1906316 0.75 ALOX15 (0.48) ATMKMT2AMEN1TSHRKDM4E
SCHEMBL9545140 0.75 POLB (0.51) POLBATMKMT2AMEN1USP2
SCHEMBL28681589 0.74 MAOA (0.95) MAOAMAOBATMKMT2AMEN1

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
CN-106317009-A Xanthene polyurethane hapten and artificial antigen and application thereof 华南农业大学 2017-01-11 CN disclosed