SCHEMBL8071341

SCHEMBL8071341

CC1(C)CC(O)c2cc(Cl)cc(Cl)c2O1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.47
CNR2 P34972 13/20 0.47
HTR2A P28223 1/20 0.42
KCNH2 Q12809 8/20 0.35
AKR1B1 P15121 1/20 0.35
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
TLR3 O15455 1/20 0.33

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
SCHEMBL3582825 0.81 CNR1 (0.45) CNR1CNR2HTR2AAKR1B1
SCHEMBL617187 0.78 TRPM8 (0.36) CNR1CNR2HTR2AAKR1B1
SCHEMBL11480145 0.77 TRPM8 (0.35) CNR1CNR2HTR2AAKR1B1
SCHEMBL23422963 0.74 KMT2A (0.36) CNR1CNR2HTR2AKCNH2AKR1B1
SCHEMBL8071498 0.71 KCNE1 (0.35) HTR2AAKR1B1USP2MAPT
SCHEMBL8071499 0.71 KCNE1 (0.35) HTR2AAKR1B1USP2MAPT
SCHEMBL8071501 0.71 KCNE1 (0.35) HTR2AAKR1B1USP2MAPT
SCHEMBL11255709 0.69 SLC6A2 (0.40) CNR1CNR2HTR2A
SCHEMBL8069942 0.69 TLR3 (0.41) CNR1CNR2AKR1B1TLR3
SCHEMBL11476102 0.68 CNR1 (0.35) CNR1CNR2HTR2AAKR1B1

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-6071953-A Sulfonamide-substituted chromans, processes for their preparation, their use as medicament or diagnostic aid, and medicament comprising them HOECHST AKTIENGESELLSCHAFT (DE) 2000-06-06 US disclosed
EP-0860440-A1 Sulfonamido substituted chromane derivatives with potassium channel blocking activity HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-26 EP disclosed