SCHEMBL10592416

SCHEMBL10592416

O=C(O)Cc1ccc(C(O)CNC(=O)C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.48
▸ BCAT2 O15382 1/20 0.43
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ RXRA P19793 2/20 0.40
▸ RXRB P28702 2/20 0.40
▸ RXRG P48443 2/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CAMK2A Q9UQM7 1/20 0.40
▸ ADRB1 P08588 2/20 0.39
▸ ADRB3 P13945 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.39
▸ ADRB2 P07550 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ TSHR P16473 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
SCHEMBL9778048 0.85 CYP4F2 (0.44) ALOX15NPC1SMN1; SMN2LMNAGAA
SCHEMBL9778026 0.77 ADRB2 (0.47) NPC1SMN1; SMN2ADRB1ADRB3KDM4E
SCHEMBL32672363 0.72 BCAT2 (0.60) BCAT2NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL22591171 0.72 EPHX2 (0.42) RAB9ASMN1; SMN2CA2LMNAEPHX2
SCHEMBL3982915 0.71 MEN1 (0.56) NPC1RAB9ASMN1; SMN2CA2KDM4E
SCHEMBL4348072 0.71 LMNA (0.55) ALOX15RXRARXRBRXRGCA2
SCHEMBL9777978 0.70 SLC7A5 (0.44) BCAT2NPC1RAB9AADRB1ADRB3
SCHEMBL20289367 0.70 HPGD (0.42) RAB9ASMN1; SMN2LMNAEPHX2NR1H4
SCHEMBL2754731 0.70 BCAT2 (0.42) BCAT2NPC1RAB9ASMN1; SMN2ADRB1
SCHEMBL6896399 0.69 CA2 (0.58) CA2CAMK2AKDM4EAKR1B1ABCC4

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
EP-0345572-A2 Sulfonamide derivatives, their preparation and pharmaceuticals containing them BASF Aktiengesellschaft (DE) 1989-12-13 — — EP disclosed
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