SCHEMBL11828016

SCHEMBL11828016

CCCCCCCCCCCCOc1ccc(C=CCO)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR5A1 Q13285 1/20 0.57
▸ AHR P35869 1/20 0.53
▸ TP53 P04637 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ LTA4H P09960 2/20 0.50
▸ PLA2G4B P0C869 1/20 0.50
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ RARB P10826 3/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ CHRNA7 P36544 2/20 0.47
▸ CHRNA10 Q9GZZ6 2/20 0.47
▸ CHRNA9 Q9UGM1 2/20 0.47

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
SCHEMBL11828330 1.00 NR5A1 (0.57) NR5A1AHRTP53TSHRLTA4H
SCHEMBL11828011 1.00 NR5A1 (0.57) NR5A1AHRTP53TSHRLTA4H
SCHEMBL11828325 1.00 NR5A1 (0.57) NR5A1AHRTP53TSHRLTA4H
SCHEMBL11827899 0.95 AHR (0.57) NR5A1AHRLTA4HABCG2CHRNA7
SCHEMBL11827906 0.95 AHR (0.57) NR5A1AHRLTA4HABCG2CHRNA7
SCHEMBL23159272 0.88 PTGS1 (0.58) AHRLTA4HABCG2NPC1LMNA
SCHEMBL12312180 0.86 AHR (0.67) NR5A1AHRTP53TSHRLTA4H
SCHEMBL23998046 0.86 AHR (0.67) NR5A1AHRTP53TSHRLTA4H
SCHEMBL2044215 0.86 AHR (0.67) NR5A1AHRTP53TSHRLTA4H
SCHEMBL2043353 0.86 AHR (0.67) NR5A1AHRTP53TSHRLTA4H

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-3995054-A MITICIDES ZOECON CORPORATION (US) 1976-11-30 — — US disclosed
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