SCHEMBL6992458

SCHEMBL6992458

CNCC1OC(C2CCN(C(C)c3ccc(F)cc3)CC2)Cc2c1ccc(OC)c2OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 3/20 0.42
TEAD1 P28347 2/20 0.36
KCNH2 Q12809 3/20 0.36
HTR2A P28223 3/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
DRD3 P35462 2/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD2 P14416 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CNR1 P21554 1/20 0.36
SLC6A2 P23975 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 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
SCHEMBL7001481 0.84 DRD1 (0.63) DRD1HTR2CADRA2BADRA2CADRA1A
SCHEMBL6998092 0.82 HTR2A (0.51) DRD1KCNH2HTR2AHTR2CHTR2B
SCHEMBL6998755 0.75 DRD1 (0.43) DRD1HTR2AADRA1AGRM2
SCHEMBL6998747 0.75 DRD1 (0.43) DRD1HTR2AADRA1AGRM2
SCHEMBL6998751 0.75 DRD1 (0.43) DRD1HTR2AADRA1AGRM2
SCHEMBL6998063 0.73 L3MBTL1 (0.37) HTR2ADRD3LMNACNR1HTT
SCHEMBL6998050 0.73 L3MBTL1 (0.37) HTR2ADRD3LMNACNR1HTT
SCHEMBL6998054 0.73 L3MBTL1 (0.37) HTR2ADRD3LMNACNR1HTT
SCHEMBL7001096 0.73 HTR2A (0.49) DRD1KCNH2HTR2AHTR2CHTR2B
SCHEMBL6999111 0.71 L3MBTL1 (0.40) DRD1HTR2AHTR2CDRD3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015446-B1 (4-PIPERIDINYL)-1H-2-BENZOPYRAN DERIVATIVES USEFUL AS ANTIPSYCHOTIC AGENTS AVENTIS PHARMA INC (US) 2003-04-02 EP claimed
EP-1015446-A1 (4-PIPERIDINYL)-1H-2-BENZOPYRAN DERIVATIVES USEFUL AS ANTIPSYCHOTIC AGENTS Aventis Pharmaceuticals Inc. (US) 2000-07-05 EP claimed
US-6004982-A SIDE EFFECT REDUCTION; SCHIZOPHRENIA HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US claimed
WO-1998034933-A1 (4-PIPERIDINYL)-1H-2-BENZOPYRAN DERIVATIVES USEFUL AS ANTIPSYCHOTIC AGENTS HOECHST MARION ROUSSEL, INC. (US) 1998-08-13 WO claimed