SCHEMBL7313692

SCHEMBL7313692

CCCc1nn(C)c(C(N)=O)c1NC(=O)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.52
MAPK8 P45983 1/20 0.46
MCHR1 Q99705 1/20 0.46
LMNA P02545 3/20 0.43
POLB P06746 1/20 0.43
NLRP3 Q96P20 1/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ADORA2B P29275 1/20 0.42
ADORA1 P30542 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
RORC P51449 4/20 0.41
PTGER4 P35408 1/20 0.41
PTGDR2 Q9Y5Y4 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
SCHEMBL7315114 0.86 TERT (0.54) TERTLMNAPOLBNLRP3MAPT
SCHEMBL7319178 0.86 TERT (0.54) TERTLMNAPOLBNLRP3SMN1; SMN2
SCHEMBL7316154 0.83 TERT (0.52) TERTMAPK8LMNAPOLBNLRP3
SCHEMBL7308029 0.82 TERT (0.57) TERTLMNAMAPTSMN1; SMN2
SCHEMBL7315148 0.79 AOC3 (0.51) TERTLMNAPOLBL3MBTL1SMN1; SMN2
SCHEMBL7305741 0.78 MAPK8 (0.49) TERTMAPK8ADORA2BADORA1HDAC1
SCHEMBL7311743 0.77 TERT (0.53) TERTLMNAPOLBMAPTATM
SCHEMBL5324167 0.75 TERT (0.64) TERTLMNAMAPTATML3MBTL1
SCHEMBL6326110 0.72 TERT (0.55) TERTLMNAPOLBMAPTATM
SCHEMBL18620482 0.69 TERT (0.64) TERTLMNAPOLBMAPTATM

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
EP-0911333-B1 Pyrazolo[4,3-d]pyrimidine derivatives and pharmaceutical compositions containing them PFIZER (US) 2002-04-10 EP disclosed
US-6235742-B1 CARDIOVASCULAR DISORDERS; ANTIALLERGENS PFIZER INC. 2001-05-22 US disclosed
EP-0911333-A1 Pyrazolo[4,3-d]pyrimidine derivatives and pharmaceutical compositions containing them PFIZER INC. (US) 1999-04-28 EP disclosed