SCHEMBL19184871

SCHEMBL19184871

CCCCCCCC(C)(CCCCC)Oc1ccnc(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 13/20 0.39
▸ CNR1 P21554 11/20 0.39
▸ LOX P28300 1/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ ACAT1 P24752 1/20 0.34
▸ SOAT1 P35610 1/20 0.34
▸ CCR1 P32246 1/20 0.33
▸ CCR5 P51681 1/20 0.33
▸ CCR8 P51685 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.32

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
SCHEMBL19184890 0.99 CNR2 (0.38) CNR2CNR1LOXLOXL2KDM4E
SCHEMBL19184862 0.82 CNR1 (0.39) CNR2CNR1PPARGPPARA
SCHEMBL19184867 0.78 MEN1 (0.38) CNR2CNR1KDM4E
SCHEMBL25454051 0.77 LOX (0.41) CNR2CNR1LOXLOXL2KDM4E
SCHEMBL10263563 0.76 CYP2D6 (0.47) LOXLOXL2CYP3A4CCR1CCR5
SCHEMBL17471315 0.75 LOX (0.46) LOXLOXL2KDM4ECCR1CCR5
SCHEMBL22375314 0.75 CNR2 (0.39) CNR2CNR1LOXLOXL2KDM4E
SCHEMBL18995657 0.74 KDM4E (0.39) CNR2CNR1KDM4EALOX15TSHR
SCHEMBL26326739 0.71 LOX (0.42) CNR2CNR1LOXLOXL2
SCHEMBL12093512 0.70 LOX (0.52) LOXLOXL2TP53CYP3A4CCR1

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-9718825-B2 N-(4-(azaindazol-6-yl)-phenyl)-sulfonamides and their use as pharmaceuticals SANOFI (FR) 2017-08-01 — — US disclosed
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