SCHEMBL11547388

SCHEMBL11547388

CCOC(=O)c1nc2nc3ccc(Cl)cc3cc2c(=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.44
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
ADORA3 P0DMS8 2/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
CSF1R P07333 1/20 0.42
ALOX5 P09917 1/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
SCHEMBL11546345 0.86 TSHR (0.55) KDM4EALDH1A1HPGDHSD17B10ALOX5
SCHEMBL11549134 0.85 ALDH1A1 (0.43) KDM4EALDH1A1HPGDHSD17B10PDE3B
SCHEMBL11550262 0.85 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10PDE3B
SCHEMBL11547661 0.85 RAB9A (0.46) KDM4EALDH1A1HPGDHSD17B10PDE3B
SCHEMBL689649 0.84 ALDH1A1 (0.53) ALOX15KDM4EALDH1A1HPGDHSD17B10
SCHEMBL11549156 0.83 ALDH1A1 (0.41) KDM4EALDH1A1HPGDHSD17B10PDE3B
SCHEMBL13343406 0.82 ALOX15 (0.51) ALOX15KDM4EALDH1A1HPGDADORA3
SCHEMBL11546546 0.81 CDK1 (0.45) KDM4EALDH1A1HPGDHSD17B10PDE3B
Pirolate SCHEMBL11546568 0.81 SRC (0.51) KDM4EALDH1A1HPGDHSD17B10PDE3B
SCHEMBL11548273 0.80 TSHR (0.44) KDM4EALDH1A1HPGDHSD17B10ALOX5

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-4134981-A ANTIALLERGENS PFIZER INC. (US) 1979-01-16 US disclosed
US-4120962-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1978-10-17 US disclosed
US-4044134-A FUSED WITH QUINOLINE OR PYRIDINE, 2-METHYL, ETHYL, OR ACETYL GROUP PFIZER INC. (US) 1977-08-23 US disclosed
US-3974161-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1976-08-10 US disclosed