SCHEMBL29772281

SCHEMBL29772281

COc1ccc(CNc2ncnc3c2c(Cl)cn3[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 5/20 0.51
▸ SIGMAR1 Q99720 3/20 0.51
▸ HTR1D P28221 1/20 0.51
▸ TMEM97 Q5BJF2 1/20 0.51
▸ ADORA3 P0DMS8 3/20 0.51
▸ ADORA2A P29274 2/20 0.51
▸ ADORA1 P30542 2/20 0.51
▸ PRMT5 O14744 2/20 0.48
▸ METTL3 Q86U44 2/20 0.48
▸ ADRA2C P18825 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ HTR6 P50406 1/20 0.45

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
SCHEMBL23313210 1.00 HTR2B (0.51) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL23273841 0.86 PRMT5 (0.45) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL29772268 0.86 PRMT5 (0.45) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL29772276 0.84 PRMT5 (0.55) PRMT5METTL3
SCHEMBL23313202 0.84 PRMT5 (0.55) PRMT5METTL3
SCHEMBL29611607 0.83 ADORA1 (0.54) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL27090409 0.83 ADORA1 (0.54) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL24313826 0.79 HTR2B (0.41) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL29611113 0.79 HTR2B (0.41) HTR2BSIGMAR1HTR1DTMEM97ADORA3
SCHEMBL27090421 0.79 HTR2B (0.41) HTR2BSIGMAR1HTR1DTMEM97ADORA3

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
CN-115298179-A METTL3 modulators 埃克森特治疗公司 2022-11-04 — — CN disclosed
EP-4048674-A2 METTL3 MODULATORS Accent Therapeutics, Inc. (US) 2022-08-31 — — EP disclosed
WO-2021079196-A9 METTL3 MODULATORS ACCENT THERAPEUTICS, INC (US) 2022-07-14 — — WO disclosed
Send feedback