SCHEMBL2059873

SCHEMBL2059873

C1=C2Oc3ccccc3N=C2C(=Nc2ccccc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL624417 0.63 CYP1A2 (0.41) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL18786507 0.61 ALDH1A1 (0.45) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL13189924 0.59 MAOA (0.40) NPC1LMNAGAARAB9A
SCHEMBL6567554 0.58 MAOA (0.42) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL27366096 0.57 CYP1A2 (0.34) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL3136409 0.56 CYP1A2 (0.36) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL37435600 0.56 CYP1A2 (0.36) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL5438463 0.56 HDAC3 (0.61) KDM4ENPC1ALDH1A1LMNAGAA
SCHEMBL30204575 0.55 DRD2 (0.39) KDM4EALDH1A1MAPT
SCHEMBL23043073 0.54 CYP1A2 (0.32) KDM4ENPC1ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10261044-B2 Electrochemical test sensor ASCENSIA DIABETES CARE HOLDINGS AG (CH) 2019-04-16 US claimed
US-20160356738-A1 Biosensor System Having Enhanced Stability and Hematocrit Performance BAYER HEALTHCARE LLC 2016-12-08 US claimed
US-9459229-B2 Electrochemical test sensor Ascenia Diabetes Care Holdings AG (CH) 2016-10-04 US claimed
US-20160084792-A1 ELECTROCHEMICAL TEST SENSOR ASCENSIA DIABETES CARE HOLDINGS AG (CH) 2016-03-24 US claimed
US-7862696-B2 electrochemical sensor strips; By reducing the amount of mediator and/or enzyme used on the sensor strip, the long-term stability of the reagent composition may be increased in relation to conventional biosensors and reagent compositions BAYER HEALTHCARE LLC (US) 2011-01-04 US claimed