SCHEMBL8306355

SCHEMBL8306355

O=Cc1cc(Br)cc(Oc2cccnc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
HTT P42858 1/20 0.48
ALDH1A1 P00352 5/20 0.43
GRM5 P41594 1/20 0.43
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYP19A1 P11511 3/20 0.41
FFAR4 Q5NUL3 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LTA4H P09960 1/20 0.38

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
SCHEMBL8304733 0.84 LMNA (0.66) LMNATDP1HTTALDH1A1GRM5
SCHEMBL2531633 0.81 LMNA (0.68) LMNATDP1HTTALDH1A1KMT2A
SCHEMBL30218733 0.81 LMNA (0.68) LMNATDP1HTTALDH1A1KMT2A
SCHEMBL433465 0.78 KDM4E (0.58) LMNATDP1HTTALDH1A1KMT2A
SCHEMBL31238435 0.78 KDM4E (0.58) LMNATDP1HTTALDH1A1KMT2A
SCHEMBL4457253 0.77 LMNA (0.56) LMNATDP1HTTALDH1A1GRM5
SCHEMBL2180955 0.77 LMNA (0.56) LMNATDP1HTTALDH1A1GRM5
SCHEMBL2193231 0.76 LMNA (0.63) LMNATDP1HTTALDH1A1GRM5
SCHEMBL8306534 0.76 CCNC (0.44) LMNATDP1GRM5CYP1A2MAPT
SCHEMBL8306537 0.76 CCNC (0.44) LMNATDP1GRM5CYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579618-B1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES PFIZER LTD (GB) 1999-10-13 EP disclosed
US-5705523-A THROMBOXANE A2 SYNTHETASE INHIBITORS PFIZER INC. (US) 1998-01-06 US disclosed
US-5457118-A Pyridine derived agents for cardiovascular diseases PFIZER INC. (US) 1995-10-10 US disclosed
EP-0579618-A1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES Pfizer Limited (GB) 1994-01-26 EP disclosed
WO-1992017451-A1 PYRIDINE- AND IMIDAZOLE-DERIVED AGENTS FOR CARDIOVASCULAR DISEASES PFIZER LIMITED (GB) 1992-10-15 WO disclosed