SCHEMBL11843347

SCHEMBL11843347

CN(C)C1CCN(C2c3ccccc3Oc3ccccc32)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CHRM2 P08172 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ CHRM3 P20309 1/20 0.40
▸ ACHE P22303 2/20 0.39
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ HTR2A P28223 4/20 0.38
▸ HTR2C P28335 4/20 0.38
▸ HRH1 P35367 2/20 0.38
▸ L3MBTL3 Q96JM7 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL11852623 0.91 CHRM2 (0.41) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11837989 0.89 HSD17B1 (0.38) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11855638 0.89 KMT2A (0.40) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11850300 0.87 ALDH1A1 (0.42) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11842265 0.86 DRD1 (0.48) USP2KDM4EMAPTTSHRHTR2A
SCHEMBL11850634 0.86 IRAK4 (0.37) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11845227 0.83 HTR2A (0.39) USP2KDM4EMAPTTSHRHTR2A
SCHEMBL11855903 0.82 KDM4E (0.43) USP2KDM4EMAPTTSHRCHRM2
SCHEMBL11851331 0.80 HTR2A (0.39) HTR2AHTR2CHRH1L3MBTL3MEN1
SCHEMBL11841936 0.79 TSHR (0.42) USP2KDM4EMAPTTSHRCHRM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3980788-A XANTHENYL COMPOUNDS SMITHKLINE CORPORATION (US) 1976-09-14 — — US claimed
US-3980788-A XANTHENYL COMPOUNDS SMITHKLINE CORPORATION (US) 1976-09-14 — — US disclosed
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