SCHEMBL22493477

SCHEMBL22493477

CNc1ccc(CCN[C@H](C)Cc2ccc(OC)cc2)c(C)n1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.51
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HTT P42858 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ SLC2A1 P11166 2/20 0.44
▸ ADRB2 P07550 4/20 0.40
▸ ADRB3 P13945 1/20 0.40

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
SCHEMBL22493833 0.86 SIGMAR1 (0.54) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL22493455 0.85 SIGMAR1 (0.46) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL23541650 0.81 MEN1 (0.49) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL22481135 0.78 ADRB2 (0.54) ADRB2ADRB3
SCHEMBL22480918 0.74 MEN1 (0.52) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL22493445 0.74 SIGMAR1 (0.49) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL22493353 0.73 HTT (0.56) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL4019777 0.72 SIGMAR1 (0.84) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL3621767 0.72 SIGMAR1 (0.84) SIGMAR1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL19505478 0.72 SIGMAR1 (0.84) SIGMAR1MEN1KMT2AHTTSMN1; SMN2

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
WO-2023225021-A1 COMPOSITIONS AND METHODS FOR TREATING PATIENTS WITH AMYOTROPHIC LATERAL SCLEROSIS (ALS) CURASEN THERAPEUTICS, INC. (US) 2023-11-23 — — WO disclosed
WO-2020198466-A9 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. (US) 2020-12-30 — — WO disclosed
WO-2020198466-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. (US) 2020-10-01 — — WO disclosed
Send feedback