SCHEMBL28754288

SCHEMBL28754288

O=CNc1ccccc1OC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
MRGPRX1 Q96LB2 1/20 0.45
CARM1 Q86X55 2/20 0.39
PRMT1 Q99873 2/20 0.39
MCHR1 Q99705 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE5A O76074 3/20 0.39
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE1C Q14123 1/20 0.39
PDE4D Q08499 4/20 0.38
PDE4A P27815 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4C Q08493 2/20 0.38
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
PTGS2 P35354 1/20 0.36

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
SCHEMBL2242864 0.76 MCHR1 (0.51) MRGPRX1CARM1PRMT1MCHR1PDE5A
SCHEMBL10777264 0.76 MRGPRX1 (0.56) TSHRMRGPRX1SMN1; SMN2PDE5APDE1A
SCHEMBL28333036 0.76 MRGPRX1 (0.46) TSHRMRGPRX1CARM1PRMT1MCHR1
SCHEMBL8105869 0.76 ADRA1A (0.51) TSHRMRGPRX1SMN1; SMN2PDE5AHPGD
SCHEMBL8523784 0.75 PTGS1 (0.61) TSHRMRGPRX1CARM1PRMT1SMN1; SMN2
SCHEMBL9501563 0.75 MRGPRX1 (0.49) TSHRMRGPRX1SMN1; SMN2PDE4DMAPT
SCHEMBL11779563 0.75 SRC (0.49) CARM1PRMT1MCHR1SMN1; SMN2HPGD
SCHEMBL5344402 0.74 MCHR1 (0.49) MRGPRX1CARM1PRMT1MCHR1PDE5A
SCHEMBL8115364 0.74 ADRA1A (0.52) TSHRMRGPRX1PDE5AHPGDKDM4E
SCHEMBL10848411 0.74 TSHR (0.43) TSHRMRGPRX1PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108409684-B N- (2-cyclohexyloxyphenyl) amide compound and preparation method and application thereof 上海晓明检测技术服务有限公司 2022-04-12 CN claimed
CN-108409684-B N- (2-cyclohexyloxyphenyl) amide compound and preparation method and application thereof 上海晓明检测技术服务有限公司 2022-04-12 CN disclosed
CN-108409684-B N- (2-cyclohexyloxyphenyl) amide compound and preparation method and application thereof 上海晓明检测技术服务有限公司 2022-04-12 CN disclosed
CN-108409684-B N- (2-cyclohexyloxyphenyl) amide compound and preparation method and application thereof 上海晓明检测技术服务有限公司 2022-04-12 CN disclosed