SCHEMBL11546006

SCHEMBL11546006

CC/C(C)=C/CCC(C)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL11546011 1.00 ALOX15 (0.35) ALOX15ALDH1A1TSHRKDM4EKMT2A
SCHEMBL3948582 0.92 KMT2A (0.45) ALOX15ALDH1A1KDM4EKMT2AKDM1A
SCHEMBL3948580 0.92 KMT2A (0.45) ALOX15ALDH1A1KDM4EKMT2AKDM1A
SCHEMBL11550948 0.86 KDM1A (0.33) ALDH1A1TSHRKDM4EKDM1A
SCHEMBL11550950 0.86 KDM1A (0.33) ALDH1A1TSHRKDM4EKDM1A
SCHEMBL108504 0.83 KDM1A (0.39) ALOX15ALDH1A1TSHRKMT2AKDM1A
SCHEMBL27176381 0.83 KDM1A (0.39) ALOX15ALDH1A1TSHRKMT2AKDM1A
SCHEMBL108503 0.83 KDM1A (0.39) ALOX15ALDH1A1TSHRKMT2AKDM1A
SCHEMBL11866290 0.83 ALOX15 (0.39) ALOX15ALDH1A1
SCHEMBL11866294 0.83 ALOX15 (0.39) ALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103070471-B A kind of edible cigarette and preparation method thereof FANG LI (CN) 2015-08-05 CN disclosed
CN-103082398-B Carrier for edible tobacco FANG LI 2015-02-25 CN disclosed
CN-103082399-B Snuff and preparation method thereof FANG LI 2015-02-04 CN disclosed
CN-103082399-A Snuff and preparation method thereof FANG LI 2013-05-08 CN disclosed
CN-103082398-A Carrier for edible tobacco FANG LI 2013-05-08 CN disclosed
CN-103070471-A Edible cigarette and preparation method thereof FANG LI 2013-05-01 CN disclosed
US-4137273-A INSECTICIDES, CHEMICAL INTERMEDIATES ZOECON CORPORATION (US) 1979-01-30 US disclosed