SCHEMBL28056033

SCHEMBL28056033

Cc1cc(C)cc(C)c1.O=Pc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
TPMT P51580 1/20 0.37
FFAR4 Q5NUL3 1/20 0.35
TSPO P30536 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
CYP1A2 P05177 2/20 0.33
FTO Q9C0B1 1/20 0.33
TP53 P04637 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL23630899 1.00 ACHE (0.41) ACHETSHRLMNAALOX12TPMT
SCHEMBL205352 0.84
SCHEMBL66878 0.84
Hydrochloric Acid SCHEMBL11330780 0.81 ALDH1A1 (0.33) ACHETSHRLMNAALOX12ALDH1A1
Hydrochloric Acid SCHEMBL28464511 0.81
Ammonia Solution, Strong SCHEMBL8134574 0.81 ALDH1A1 (0.33) TSHRLMNAALDH1A1MAPTCES2
SCHEMBL8134576 0.81 ALDH1A1 (0.33) ACHETSHRLMNAALOX12ALDH1A1
Hydrochloric Acid SCHEMBL11325701 0.81 ALDH1A1 (0.33) ACHETSHRLMNAALOX12ALDH1A1
Bromide SCHEMBL28968019 0.81 ALDH1A1 (0.33) TSHRLMNAALDH1A1MAPTCES2
SCHEMBL27787772 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104411793-B Adhesive composition containing UV curable rubber and protective film using same 株式会社LG化学 2017-12-22 CN disclosed
CN-105392616-A Method for preparing reinforcing rib ASAMER BASALTIC FIBERS GMBH 2016-03-09 CN disclosed