SCHEMBL27414286

SCHEMBL27414286

C=Cc1ccc(N)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.62
TRPA1 O75762 1/20 0.61
ALDH1A1 P00352 5/20 0.55
CYP3A4 P08684 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
TSHR P16473 2/20 0.55
HSD17B10 Q99714 1/20 0.55
TUBB4A P04350 3/20 0.46
TUBB P07437 3/20 0.46
TUBA3C P0DPH7 3/20 0.46
TUBA1B P68363 3/20 0.46
TUBA4A P68366 3/20 0.46
TUBB4B P68371 3/20 0.46
TUBB3 Q13509 3/20 0.46
TUBB2A Q13885 3/20 0.46
TUBB8 Q3ZCM7 3/20 0.46
TUBA3E Q6PEY2 3/20 0.46
TUBA1A Q71U36 3/20 0.46
TUBA1C Q9BQE3 3/20 0.46
TUBB6 Q9BUF5 3/20 0.46

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
SCHEMBL357217 0.84 APP (0.62) APPTRPA1ALDH1A1CYP3A4TDP1
SCHEMBL5720639 0.83 APP (0.85) APPALDH1A1CYP3A4TDP1TSHR
SCHEMBL5720643 0.83 APP (0.85) APPALDH1A1CYP3A4TDP1TSHR
SCHEMBL29778007 0.81 TRPA1 (0.68) APPTRPA1ALDH1A1TDP1TSHR
SCHEMBL33786 0.81 TRPA1 (0.68) APPTRPA1ALDH1A1TDP1TSHR
SCHEMBL2774349 0.80 ALDH1A1 (0.68) APPALDH1A1CYP3A4TDP1TSHR
Methoxymethane SCHEMBL28668338 0.79 TRPA1 (0.66) APPTRPA1ALDH1A1TDP1TSHR
SCHEMBL30882817 0.79 TRPA1 (0.66) APPTRPA1ALDH1A1TDP1TSHR
Ethylene SCHEMBL28209809 0.79 TRPA1 (0.66) APPTRPA1ALDH1A1TDP1TSHR
SCHEMBL25990122 0.78 APP (0.71) APPALDH1A1CYP3A4TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024128157-A1 COMPOSITION FOR FORMING RESIST UNDERLAYER FILM 日産化学株式会社 2024-06-20 WO disclosed
CN-102206428-B Novel responsive dye possessing N-alkylamino radical ETHICAL INTERNAT TRADING & WAREHOUSING SHANGHAI CO LTD 2014-05-28 CN disclosed
CN-102206428-A Novel responsive dye possessing N-alkylamino radical ETHICAL INTERNAT TRADING & WAREHOUSING SHANGHAI CO LTD 2011-10-05 CN disclosed