Ethylbenzene

Ethylbenzene

SCHEMBL9702634

CCc1ccc(C(=O)O)cc1.CCc1ccccc1

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.87
TAS2R14 Q9NYV8 1/20 0.64
RXRA P19793 2/20 0.62
RXRB P28702 2/20 0.62
BCL2 P10415 1/20 0.62
TP53 P04637 2/20 0.61
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TSHR P16473 2/20 0.54
DAO P14920 1/20 0.54
NAPRT Q6XQN6 1/20 0.54
LMNA P02545 2/20 0.53
PLK1 P53350 1/20 0.53
SRD5A2 P31213 4/20 0.53
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
HPGD P15428 1/20 0.53
CES2 O00748 1/20 0.52

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
Terephthalic Acid SCHEMBL27701083 0.94 ALDH1A1 (0.76) ALDH1A1TAS2R14RXRARXRBBCL2
Benzoic Acid SCHEMBL11033702 0.93 ALDH1A1 (0.75) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL1330335 0.93 ALDH1A1 (1.00) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL1330795 0.93 ALDH1A1 (1.00) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL19901 0.93 ALDH1A1 (1.00) ALDH1A1TAS2R14RXRARXRBBCL2
Benzoic Acid SCHEMBL28095659 0.91 ALDH1A1 (0.72) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL2590166 0.91 ALDH1A1 (0.95) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL6909050 0.91 ALDH1A1 (0.95) ALDH1A1TAS2R14RXRARXRBBCL2
Ammonia Solution, Strong SCHEMBL22042012 0.91 ALDH1A1 (0.95) ALDH1A1TAS2R14RXRARXRBBCL2
SCHEMBL6913296 0.91 ALDH1A1 (0.95) ALDH1A1TAS2R14RXRARXRBBCL2

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
EP-0491176-A1 Silver halide photographic light-sensitive material improved in anti-jamming property KONICA CORPORATION (JP) 1992-06-24 EP disclosed