SCHEMBL10670972

SCHEMBL10670972

O=C(N1CC=C(c2ccc(Cl)cc2)CC1)N(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ SIGMAR1 Q99720 7/20 0.52
▸ NPC1 O15118 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ CASP3 P42574 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ SENP8 Q96LD8 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ SENP6 Q9GZR1 1/20 0.50
▸ DRD2 P14416 1/20 0.50
▸ CNR1 P21554 1/20 0.48
▸ CCR1 P32246 1/20 0.45
▸ MAPK1 P28482 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL10668646 0.87 CNR1 (0.59) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL10672727 0.77 ALDH1A1 (0.57) MAPTLMNAHTTNPC1ALDH1A1
SCHEMBL5542441 0.77 ALDH1A1 (0.60) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL5534769 0.75 CNR1 (0.59) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL15556551 0.75 CNR1 (0.63) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL4602817 0.75 ALDH1A1 (0.66) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL14393509 0.74 QDPR (0.67) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL14197130 0.73 NAMPT (0.58) MAPTLMNASIGMAR1NPC1ALDH1A1
SCHEMBL8093113 0.73 DRD2 (0.53) MAPTNPSR1LMNAHTTSIGMAR1
SCHEMBL14224507 0.70 MAPK1 (0.58) MAPTSIGMAR1NPC1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4782071-A Tetrasubstituted urea cholinergic agents WARNER-LAMBERT COMPANY (US) 1988-11-01 — — US disclosed
Send feedback