SCHEMBL31023151

SCHEMBL31023151

CCc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HIF1A Q16665 1/20 0.56
VCAM1 P19320 1/20 0.53
KAT2B Q92831 1/20 0.52
LMNA P02545 7/20 0.49
RECQL P46063 1/20 0.49
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
TDP1 Q9NUW8 2/20 0.44
ATM Q13315 1/20 0.44
MAPT P10636 4/20 0.42
HTT P42858 3/20 0.42
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MITF O75030 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA1 P00915 1/20 0.42
MMP2 P08253 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ITGB1 P05556 1/20 0.42

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
SCHEMBL10315544 1.00 ALDH1A1 (0.56) ALDH1A1HIF1AVCAM1KAT2BLMNA
SCHEMBL12208065 0.85 TDP1 (0.58) ALDH1A1HIF1AVCAM1KAT2BLMNA
SCHEMBL14880650 0.85 ALDH1A1 (0.60) ALDH1A1HIF1AVCAM1LMNARECQL
SCHEMBL3120356 0.83 ALDH1A1 (0.58) ALDH1A1HIF1AVCAM1LMNARECQL
SCHEMBL10959235 0.82 TSHR (0.55) ALDH1A1KAT2BLMNAKMT2AMEN1
SCHEMBL6356240 0.82 SMN1; SMN2 (0.49) ALDH1A1HIF1AVCAM1KAT2BLMNA
SCHEMBL7615803 0.81 ALDH1A1 (0.56) ALDH1A1HIF1AVCAM1KAT2BLMNA
SCHEMBL4124874 0.81 ALDH1A1 (0.56) ALDH1A1HIF1AVCAM1LMNARECQL
SCHEMBL14899811 0.81 ALDH1A1 (0.56) ALDH1A1HIF1AVCAM1LMNARECQL
SCHEMBL29990481 0.81 ALDH1A1 (0.56) ALDH1A1HIF1AVCAM1LMNARECQL

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
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 WO disclosed