SCHEMBL27788932

SCHEMBL27788932

O=C(OC1CCCCC1)c1cn(C2CCCCC2)c2nc(Cl)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.41
▸ CHRM2 P08172 2/20 0.39
▸ DRD1 P21728 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ HTR3A P46098 1/20 0.37
▸ TOP2A P11388 3/20 0.37
▸ TOP2B Q02880 3/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ABCC4 O15439 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ CSF1R P07333 1/20 0.35

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
SCHEMBL27789261 0.86 DPP4 (0.52) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL27788937 0.86 DPP4 (0.40) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL17270378 0.84 DPP4 (0.48) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL5422476 0.80 ADRB2 (0.51) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL500472 0.80 DPP4 (0.57) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL23498281 0.79 DPP4 (0.49) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL10996251 0.78 LMNA (0.48) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL17537004 0.77 DPP4 (0.47) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL4774919 0.75 DPP4 (0.44) DPP4CHRM2DRD1KDM4EALDH1A1
SCHEMBL30510604 0.74 DPP4 (0.37) DPP4CHRM2DRD1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101792443-A Fluoro-carbostyril derivative as well as preparation method and application thereof OKEANOS TECH CO LTD 2010-08-04 — — CN claimed
CN-101792443-A Fluoro-carbostyril derivative as well as preparation method and application thereof OKEANOS TECH CO LTD 2010-08-04 — — CN disclosed
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