SCHEMBL22279027

SCHEMBL22279027

Fc1ccc(CNc2ccc(N3CCC4(CC3)OCCO4)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.48
▸ KMT2A Q03164 1/20 0.46
▸ P4HTM Q9NXG6 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ GAA P10253 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ CACNA1B Q00975 2/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ CACNA1H O95180 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ STAT6 P42226 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HTR1A P08908 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
SCHEMBL22279042 0.85 P4HTM (0.47) P4HTMALDH1A1L3MBTL1GAAMAPT
SCHEMBL22279048 0.84 GAA (0.55) KMT2AP4HTMALDH1A1L3MBTL1GAA
SCHEMBL22279049 0.82 P4HTM (0.51) KMT2AP4HTMALDH1A1L3MBTL1GAA
SCHEMBL22279043 0.81 P4HTM (0.50) KMT2AP4HTMALDH1A1L3MBTL1GAA
SCHEMBL4737532 0.78 GAA (0.51) KMT2AALDH1A1L3MBTL1GAAMAPT
SCHEMBL22279046 0.74 GAA (0.46) P4HTML3MBTL1GAAMAPTSMN1; SMN2
SCHEMBL3058922 0.73 HRH4 (0.53) KMT2AL3MBTL1GAAMAPTSMN1; SMN2
SCHEMBL4738295 0.73 BPTF (0.51) P4HTML3MBTL1GAAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL3826981 0.72 HRH4 (0.52) KMT2AL3MBTL1GAAMAPTSMN1; SMN2
SCHEMBL3063613 0.71 DRD2 (0.54) ALDH1A1L3MBTL1GAAKDM4ELMNA

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
WO-2020151686-A1 N-HETEROARYL SULFONAMIDE DERIVATIVE, PREPARATION AND USE THEREOF IN TREATMENT OF AUTOIMMUNE DISEASES 杭州壹瑞医药科技有限公司 2020-07-30 — — WO disclosed
Send feedback