SCHEMBL9786848

SCHEMBL9786848

CN(C)C(=O)OCCN1CCC(C(O)(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.46
▸ EHMT2 Q96KQ7 1/20 0.46
▸ CYP2J2 P51589 4/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ KCNH2 Q12809 2/20 0.42
▸ HRH1 P35367 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ PDE3A Q14432 1/20 0.41

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
SCHEMBL9786917 0.93 PAX8 (0.48) DNMT1EHMT2CYP2J2PAX8KCNH2
SCHEMBL9786834 0.92 CYP2J2 (0.46) DNMT1EHMT2CYP2J2PAX8KCNH2
Oxalic Acid SCHEMBL9786851 0.89 CYP2J2 (0.46) CYP2J2PAX8KCNH2HRH1
SCHEMBL9786980 0.85 HRH1 (0.44) DNMT1EHMT2CYP2J2PAX8KCNH2
Hydrochloric Acid SCHEMBL9787237 0.83 HRH1 (0.43) CYP2J2PAX8HRH1LMNADRD3
SCHEMBL9873350 0.82 CYP2J2 (0.48) DNMT1EHMT2CYP2J2KCNH2HRH1
SCHEMBL9786892 0.81 CYP2J2 (0.59) CYP2J2PAX8KCNH2HRH1LMNA
SCHEMBL9874468 0.81 CYP2J2 (0.54) DNMT1EHMT2CYP2J2KCNH2DRD3
SCHEMBL9872366 0.80 CYP2J2 (0.51) DNMT1EHMT2CYP2J2KCNH2HRH1
SCHEMBL9873499 0.79 CYP2J2 (0.50) DNMT1EHMT2CYP2J2KCNH2HRH1

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-5063235-A 4-[(diaryl)hydromethyl]-1-piperidinealkanols and esters and carbamates thereof useful in the treatment of allergic disorders A. H. ROBINS COMPANY, INC. (US) 1991-11-05 — — US claimed
US-5063235-A 4-[(diaryl)hydromethyl]-1-piperidinealkanols and esters and carbamates thereof useful in the treatment of allergic disorders A. H. ROBINS COMPANY, INC. (US) 1991-11-05 — — US disclosed
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