SCHEMBL27459181

SCHEMBL27459181

CCCOC(=O)N(C)c1cccc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.46
CHRNB4 P30926 2/20 0.46
CHRNA3 P32297 2/20 0.46
CHRNA4 P43681 2/20 0.46
PTGIR P43119 4/20 0.40
LTB4R2 Q9NPC1 3/20 0.39
GRM5 P41594 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 3/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
PTGDR Q13258 1/20 0.39
RIPK1 Q13546 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
PTBP1 P26599 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2089293 0.88 LMNA (0.50) CHRNB2CHRNB4CHRNA3CHRNA4PTGIR
SCHEMBL11346154 0.84 HSD17B1 (0.48) CHRNB2CHRNB4CHRNA3CHRNA4GRM5
SCHEMBL6002508 0.84 PTGIR (0.41) CHRNB2CHRNB4CHRNA3CHRNA4PTGIR
SCHEMBL28336888 0.81 KMT2A (0.52) CHRNB2CHRNB4CHRNA3CHRNA4GRM5
SCHEMBL27766401 0.81 CHRNB2 (0.65) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL28746573 0.77 LTB4R2 (0.47) LTB4R2ALDH1A1LMNARIPK1KDM4E
SCHEMBL2089292 0.76 HPGD (0.39) PTGIRALDH1A1PTGER4PTGER3PTGER2
SCHEMBL27737848 0.74 GRM5 (0.58) CHRNB2CHRNB4CHRNA3CHRNA4GRM5
SCHEMBL7858429 0.74 CES2 (0.44) ALDH1A1LMNAKDM4ENPC1PTBP1
SCHEMBL29460301 0.74 CES2 (0.44) LTB4R2

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
CN-1495181-A Method for preparing cyclic oxazolidone containing sulfur and fluorine �������Ŷ���Լ��������˾ 2004-05-12 CN disclosed
CN-1142158-C Process for preparing cyclic sulfur and fluorine containing oxazolidinones �������Ŷ���Լ��������˾ 2004-03-17 CN disclosed
CN-1335842-A Process for preparing cyclic sulfur and fluorine containing oxazolidinones UPJOHN CO (US) 2002-02-13 CN disclosed