SCHEMBL5330701

SCHEMBL5330701

CC(CCc1ccccc1)NC(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
POLB P06746 4/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.54
HTT P42858 2/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
EPHX2 P34913 1/20 0.51
METAP2 P50579 1/20 0.51
SIGMAR1 Q99720 1/20 0.50

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
SCHEMBL5322005 0.84 ALDH1A1 (0.63) POLBALDH1A1HPGDHTTLMNA
SCHEMBL5327587 0.83 ALDH1A1 (0.74) POLBALDH1A1HPGDHTTLMNA
SCHEMBL5319979 0.80 ALDH1A1 (0.65) POLBALDH1A1HPGDHTTMEN1
SCHEMBL6297588 0.80 ALDH1A1 (0.81) POLBALDH1A1HPGDHTTMEN1
SCHEMBL5324271 0.80 ALDH1A1 (0.61) L3MBTL1POLBALDH1A1HPGDHTT
SCHEMBL19254239 0.78 ATM (0.56) ATML3MBTL1POLBHPGDGAA
SCHEMBL14398815 0.76 KMT2A (0.69) ATML3MBTL1POLBALDH1A1HPGD
SCHEMBL20456249 0.76 SMN1; SMN2 (0.65) POLBALDH1A1HPGDHTTMEN1
SCHEMBL5328820 0.76 ALDH1A1 (0.66) L3MBTL1POLBALDH1A1HPGDHTT
SCHEMBL14399009 0.76 ALDH1A1 (0.74) L3MBTL1POLBALDH1A1HPGDHTT

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