SCHEMBL7184863

SCHEMBL7184863

CCOc1ccc(C(C)(C)CC)cc1C=CC(=O)c1ccc(C(=O)N(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
ATM Q13315 1/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CYP1A1 P04798 4/20 0.46
CYP1B1 Q16678 4/20 0.46
POLB P06746 1/20 0.46
DPP4 P27487 2/20 0.42
MAOB P27338 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
ABCG2 Q9UNQ0 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL7192285 0.93 CYP1A1 (0.48) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7179055 0.91 LMNA (0.49) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL9276155 0.91 PTPN1 (0.44) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7190005 0.90 ABCG2 (0.53) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7177807 0.88 SMN1; SMN2 (0.41) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7179943 0.88 PTPN1 (0.46) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7186672 0.84 CYP1A1 (0.50) LMNAMAPTSMN1; SMN2ATMCYP1A1
SCHEMBL9273105 0.83 ABCG2 (0.46) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7192282 0.83 LMNA (0.58) LMNAMAPTSMN1; SMN2ALDH1A1ATM
SCHEMBL7184382 0.82 LMNA (0.51) LMNAMAPTSMN1; SMN2ALDH1A1ATM

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
US-6603046-B1 The invention is drawn to novel bis-aromatic a, beta -unsaturated ketones. The compounds are useful in the treatment and prophylaxis of diseases caused by parasites or bacteria. LICA PHARMACEUTICALS A/S (DK) 2003-08-05 US disclosed
EP-0634927-B1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA LICA PHARMACEUTICALS AS (DK) 2001-07-04 EP disclosed
US-5985935-A PARASITICIDES OR BACTERICIDES STATENS SERUMINSTITUT (DK) 1999-11-16 US disclosed