SCHEMBL9024465

SCHEMBL9024465

Cc1nc(C(F)(F)F)[nH]c(=O)c1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.40
HPGD P15428 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
PIM1 P11309 1/20 0.39
HCAR2 Q8TDS4 2/20 0.37
KDM5A P29375 2/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM5B Q9UGL1 1/20 0.37
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
PDE2A O00408 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL19503077 0.75 ALDH1A1 (0.50) HPGDSMN1; SMN2ALDH1A1LMNAKDM5A
SCHEMBL24900017 0.73 KDM5B (0.41) HPGDSMN1; SMN2ALDH1A1LMNAKDM5A
SCHEMBL8515729 0.69 L3MBTL1 (0.48) HPGDALDH1A1LMNAHTTKDM5B
SCHEMBL9025057 0.69 TNKS2 (0.42) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL15556424 0.69 CSNK2A1 (0.44) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL9025566 0.68 KDM4E (0.51) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL20470626 0.68 MAPT (0.41) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL11780913 0.67 HPGD (0.44) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL9024628 0.67 NPSR1 (0.60) PKMHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL13605206 0.66 SMPD3 (0.35) PKMHPGDALDH1A1HTTHCAR2

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
EP-0611368-B1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSIN II ANTAGONISTS AMERICAN HOME PROD (US) 1996-02-07 EP disclosed
EP-0611368-A1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSINE II ANTAGONISTS. AMERICAN HOME PROD (US) 1994-08-24 EP disclosed
US-5336677-A ANTAGONIST OF ANGIOTENSIN II AMERICAN HOME PRODUCTS CORPORATION (US) 1994-08-09 US disclosed
WO-1993008169-A1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSINE II ANTAGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-04-29 WO disclosed