SCHEMBL5323948

SCHEMBL5323948

CC(CCc1ccccc1)NC(=O)Cc1cccc(F)c1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
POLB P06746 3/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
CNR2 P34972 2/20 0.56
GAA P10253 1/20 0.55
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 1/20 0.55

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
SCHEMBL14399186 0.86 ALDH1A1 (0.74) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL6297588 0.86 ALDH1A1 (0.81) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5322523 0.86 ALDH1A1 (0.65) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5325411 0.85 RAB9A (0.65) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5322005 0.84 ALDH1A1 (0.63) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5325764 0.84 MEN1 (0.60) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5322502 0.83 ALDH1A1 (0.68) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL13257604 0.82 HPGD (0.74) ALDH1A1POLBMEN1KMT2AHTT
SCHEMBL5328820 0.81 ALDH1A1 (0.66) ALDH1A1POLBMEN1KMT2ACNR2
SCHEMBL5319979 0.81 ALDH1A1 (0.65) ALDH1A1POLBMEN1KMT2ACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007120083-A1 THE USE OF CARBOXAMIDE DERIVATIVES IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, ALLERGIC AND DERMATOLOGICAL CONDITIONS ASTRAZENECA AB (SE) 2007-10-25 WO claimed
WO-2007120083-A1 THE USE OF CARBOXAMIDE DERIVATIVES IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, ALLERGIC AND DERMATOLOGICAL CONDITIONS ASTRAZENECA AB (SE) 2007-10-25 WO disclosed
WO-2007120083-A1 THE USE OF CARBOXAMIDE DERIVATIVES IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, ALLERGIC AND DERMATOLOGICAL CONDITIONS ASTRAZENECA AB (SE) 2007-10-25 WO disclosed