SCHEMBL11166527

SCHEMBL11166527

CC(C)(N)c1cc(O)c(C(C)(C)N)cc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.60
▸ ALOX15 P16050 7/20 0.60
▸ MAPT P10636 4/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ CYP1A2 P05177 3/20 0.60
▸ KDM4E B2RXH2 2/20 0.60
▸ ATP2A2 P16615 1/20 0.60
▸ ATP2A3 Q93084 1/20 0.60
▸ CYP3A4 P08684 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ HSD17B10 Q99714 3/20 0.37
▸ TYR P14679 2/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ NFE2L2 Q16236 1/20 0.37
▸ TDP1 Q9NUW8 4/20 0.37

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
SCHEMBL6358586 0.95 ALDH1A1 (0.55) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL8389819 0.83 HSD17B10 (0.44) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL31166944 0.78 TYR (0.50) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL3338261 0.76 PDE10A (0.50) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL1698927 0.76 ALDH1A1 (0.45) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL38604 0.75 ALOX15 (1.00) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL11418980 0.74 ALDH1A1 (0.59) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL8392107 0.74 CYP3A4 (0.46) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2
SCHEMBL8389745 0.74 HSD17B10 (0.48) ALDH1A1ALOX15MAPTSMN1; SMN2CYP3A4
SCHEMBL8387655 0.74 ALDH1A1 (0.42) ALDH1A1ALOX15MAPTSMN1; SMN2CYP1A2

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-4377634-A SENSITIZATION OF SILVER HALIDE EMULSIONS USING AN ARYL HYDRAZIDE AND A HYDROQUIONE; NEGATIVES FUJI PHOTO FILM CO., LTD. (JP) 1983-03-22 — — US disclosed
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