SCHEMBL7367990

SCHEMBL7367990

O=C(O)c1cccnc1Oc1cncc(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.52
PTGER4 P35408 1/20 0.50
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PDE10A Q9Y233 1/20 0.46
XDH P47989 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
ADRB3 P13945 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL2332693 0.83 ALDH1A1 (0.61) RAB9APTGER4ALDH1A1POLBGAA
SCHEMBL4445418 0.83 PTGER4 (0.60) PTGER4LMNASMN1; SMN2XDHSLC22A12
SCHEMBL7369234 0.83 L3MBTL1 (0.52) RAB9AALDH1A1POLBTDP1SMN1; SMN2
SCHEMBL7368260 0.82 POLB (0.58) RAB9AALDH1A1POLBGAATDP1
SCHEMBL5216488 0.81 TDP1 (0.56) RAB9AALDH1A1TDP1LMNASMN1; SMN2
SCHEMBL2779334 0.81 RAB9A (0.76) RAB9AALDH1A1POLBGAATDP1
SCHEMBL7368043 0.78 POLB (0.48) ALDH1A1POLBGAA
SCHEMBL7372157 0.78 RAB9A (0.49) RAB9AALDH1A1POLBGAATDP1
SCHEMBL7320114 0.78 RAB9A (0.55) RAB9AALDH1A1POLBGAATDP1
SCHEMBL861902 0.78 TDP1 (0.71) RAB9AALDH1A1POLBGAATDP1

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-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
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