SCHEMBL23831771

SCHEMBL23831771

COc1cccc(NC(=O)Nc2cc(F)cc(F)c2CO)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
RAB9A P51151 6/20 0.55
ALDH1A1 P00352 3/20 0.55
HTT P42858 2/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
PTGER3 P43115 4/20 0.54
PKM P14618 2/20 0.54
MAPK1 P28482 1/20 0.54
NPC1 O15118 3/20 0.53
MITF O75030 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL30105024 0.88 PTGER3 (0.61) MAPTSMN1; SMN2TP53TSHRRAB9A
SCHEMBL23832016 0.88 PTGER3 (0.61) MAPTSMN1; SMN2TP53TSHRRAB9A
SCHEMBL30105117 0.87 NPC1 (0.53) MAPTSMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL27077619 0.87 NPC1 (0.53) MAPTSMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL23831665 0.86 EPHX2 (0.47) MAPTSMN1; SMN2TP53TSHRRAB9A
SCHEMBL30104992 0.86 EPHX2 (0.47) MAPTSMN1; SMN2TP53TSHRRAB9A
SCHEMBL23832097 0.85 MEN1 (0.56) MAPTSMN1; SMN2RAB9AHTTMEN1
SCHEMBL30104998 0.85 MEN1 (0.56) MAPTSMN1; SMN2RAB9AHTTMEN1
SCHEMBL4348995 0.84 MAPT (0.60) MAPTSMN1; SMN2TP53TSHRRAB9A
SCHEMBL23832010 0.83 SMN1; SMN2 (0.61) MAPTSMN1; SMN2TP53TSHRRAB9A

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
EP-4121415-B1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES UNIV PALACKEHO (CZ) 2024-02-07 EP disclosed
EP-4121415-A1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES Univerzita Palackého v Olomouci (CZ) 2023-01-25 EP disclosed
WO-2021185391-A1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2021-09-23 WO disclosed