SCHEMBL9850124

SCHEMBL9850124

CC(=O)c1cc([N+](=O)[O-])ccc1Nc1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 3/20 0.79
CTSL P07711 3/20 0.79
MAPT P10636 6/20 0.75
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
AKR1C3 P42330 3/20 0.62
AKR1C2 P52895 3/20 0.62
GFER P55789 2/20 0.61
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
PKM P14618 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
PPARG P37231 1/20 0.56

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
SCHEMBL354532 0.88 CTSV (1.00) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL29779874 0.82 AKR1C3 (0.67) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL4249101 0.81 CTSV (0.86) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL31563068 0.81 AKR1C3 (0.63) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL31563222 0.80 AKR1C3 (0.65) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL7589433 0.80 CTSV (0.65) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL6816232 0.80 MAPT (0.70) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL13696982 0.80 CTSV (0.73) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL9551960 0.79 CTSV (0.78) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL4164387 0.79 CTSV (0.78) CTSVCTSLMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5053325-A 2-hydrogen bond donating group-substituted benzoyl acetanilides KONICA CORPORATION (JP) 1991-10-01 US disclosed
EP-0422505-A1 Silver halide color photographic light-sensitive material KONICA CORPORATION (JP) 1991-04-17 EP disclosed
US-4996139-A Silver halide photographic light-sensitive material containing novel cyan coupler KONICA CORPORATION (JP) 1991-02-26 US disclosed
EP-0354549-A2 Silver halide photographic lightsensitive material containing novel cyan coupler KONICA CORPORATION (JP) 1990-02-14 EP disclosed