SCHEMBL23329403

SCHEMBL23329403

O=C(O)c1ccc(OC2CCN(Cc3ccc(C4CCC4)cc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.60
CCR3 P51677 2/20 0.60
KCNH2 Q12809 2/20 0.60
ADRB2 P07550 5/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
HRH3 Q9Y5N1 3/20 0.55
LTA4H P09960 3/20 0.52
SSTR5 P35346 1/20 0.52
OPRK1 P41145 1/20 0.49
FAAH O00519 1/20 0.48

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
SCHEMBL4237889 0.85 OPRK1 (0.65) HRH1CCR3KCNH2ADRB2MEN1
SCHEMBL23304422 0.82 HRH1 (0.60) HRH1CCR3KCNH2ADRB2MEN1
SCHEMBL7179272 0.79 MEN1 (0.68) MEN1KMT2ALTA4H
SCHEMBL27805654 0.77 LTA4H (0.62) MEN1KMT2AHRH3LTA4H
SCHEMBL25933641 0.76 HRH3 (0.61) HRH1CCR3KCNH2ADRB2MEN1
SCHEMBL2276951 0.76 HRH1 (0.55) HRH1CCR3KCNH2ADRB2MEN1
SCHEMBL3022521 0.76 OPRK1 (0.76) KCNH2ADRB2MEN1KMT2AHRH3
Hydrochloric Acid SCHEMBL6538607 0.75 HTR2A (0.55) KMT2AHRH3LTA4H
SCHEMBL23632055 0.75 ADRB2 (0.66) HRH1CCR3KCNH2ADRB2MEN1
SCHEMBL23632053 0.75 ADRB2 (0.66) HRH1CCR3KCNH2ADRB2MEN1

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-2021086879-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2021-05-06 WO disclosed