SCHEMBL15069002

SCHEMBL15069002

CCN1CCN(Cc2ccc(N)cc2C(F)(F)F)CC1.CCN1CCN(Cc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.61
PDE7A Q13946 1/20 0.45
ALDH1A1 P00352 3/20 0.42
CYP2D6 P10635 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MKNK2 Q9HBH9 3/20 0.42
RET P07949 3/20 0.41
KDR P35968 2/20 0.41
KMT2A Q03164 2/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 1/20 0.41
KCNJ1 P48048 1/20 0.40
MEN1 O00255 1/20 0.40
MKNK1 Q9BUB5 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
LMNA P02545 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
SCHEMBL1420633 0.93 NR1H2 (0.49) NR1H2ALDH1A1CYP2D6L3MBTL1MKNK2
SCHEMBL15068693 0.88 ALDH1A1 (0.44) NR1H2ALDH1A1CYP2D6L3MBTL1MKNK2
SCHEMBL1279087 0.87 NR1H2 (0.79) NR1H2ALDH1A1MKNK2RETKDR
SCHEMBL15688039 0.84 LMNA (0.50) NR1H2ALDH1A1KMT2AKCNJ1MAPK1
SCHEMBL588829 0.83 NR1H2 (0.62) NR1H2ALDH1A1ABL1LMNASMN1; SMN2
SCHEMBL24566522 0.83 NR1H2 (0.73) NR1H2ALDH1A1MKNK2RETKDR
SCHEMBL4105203 0.82 NR1H2 (0.48) NR1H2ALDH1A1CYP2D6KCNJ1MAPK1
SCHEMBL15687902 0.81 MEN1 (0.48) NR1H2ALDH1A1KMT2AKCNJ1MEN1
SCHEMBL15690078 0.81 ALDH1A1 (0.58) NR1H2ALDH1A1L3MBTL1KCNJ1MAPK1
SCHEMBL31391167 0.80 NR1H2 (0.48) NR1H2ALDH1A1KCNJ1MAPK1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2797927-A1 THIENO[3,2-d]PYRIMIDINE DERIVATIVES HAVING INHIBITORY ACTIVITY FOR PROTEIN KINASES Hanmi Pharm. Co., Ltd. (KR) 2014-11-05 EP disclosed
WO-2013100632-A1 THIENO[3,2-d]PYRIMIDINE DERIVATIVES HAVING INHIBITORY ACTIVITY FOR PROTEIN KINASES HANMI PHARM CO., LTD. (KR) 2013-07-04 WO disclosed