SCHEMBL7366622

SCHEMBL7366622

O=Cc1cccnc1Oc1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
NFE2L2 Q16236 2/20 0.43
LMNA P02545 1/20 0.43
MEN1 O00255 1/20 0.43
PPP1CA P62136 1/20 0.43
KMT2A Q03164 1/20 0.43
P2RY1 P47900 1/20 0.42
EGFR P00533 2/20 0.41
LCK P06239 1/20 0.41
MAPT P10636 1/20 0.41
TRIM24 O15164 1/20 0.40

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
SCHEMBL9040386 0.84 LMNA (0.47) ALDH1A1POLBGAALMNAKMT2A
SCHEMBL30703391 0.83 RAB9A (0.56) ALDH1A1POLBCYP1A2CYP2C9CYP2C19
SCHEMBL5878669 0.82 KDM4E (0.49) ALDH1A1CYP1A2LMNAMEN1KMT2A
SCHEMBL9040313 0.82 NFE2L2 (0.47) ALDH1A1CYP1A2CYP2C9CYP2C19NFE2L2
SCHEMBL4993422 0.81 KMT2A (0.55) ALDH1A1GAACYP1A2CYP2C9CYP2C19
SCHEMBL11373704 0.78 EGFR (0.47) ALDH1A1POLBGAACYP1A2CYP2C9
SCHEMBL7371098 0.77 LMNA (0.47) ALDH1A1GAALMNAKMT2ATRIM24
SCHEMBL1552831 0.77 PDE4A (0.46) ALDH1A1POLBGAACYP1A2CYP2C9
SCHEMBL6136758 0.77 PDE4A (0.55) ALDH1A1POLBGAACYP1A2CYP2C9
SCHEMBL7364733 0.77 EGFR (0.47) ALDH1A1POLBGAACYP1A2CYP2C9

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-6380218-B1 FOR THERAPY OF RESPIRATORY, ALLERGIC, AND INFLAMMATORY DISORDERS COMPRISING ASTHMA, CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ACUTE RESPIRATORY DISEASE SYNDROME, PULMONARY HYPERSENSITIVITY, AND ALLERGIC RHINITIS IN A MAMMAL PFIZER INC 2002-04-30 US disclosed
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN disclosed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP disclosed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO disclosed