SCHEMBL8287232

SCHEMBL8287232

O=C(c1ccccc1)N1CCN(c2cc3c(cn2)c(=O)cc(Nc2ccccc2)n3-c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
ALDH1A1 P00352 3/20 0.43
RAB9A P51151 1/20 0.43
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
MAPK1 P28482 2/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 2/20 0.41
GRM5 P41594 1/20 0.41
TP53 P04637 2/20 0.41
PDE11A Q9HCR9 1/20 0.40
KDM4E B2RXH2 3/20 0.39
SLC6A7 Q99884 2/20 0.39
MGLL Q99685 1/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 1/20 0.39

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
SCHEMBL8287220 0.90 CKS1B (0.41) MAPTRAB9ACKS1BSKP1SKP2
SCHEMBL8287497 0.88 PDE11A (0.46) MAPTALDH1A1RAB9AMAPK1USP2
SCHEMBL8285284 0.87 CKS1B (0.45) MAPTCKS1BSKP1SKP2PDE11A
SCHEMBL8285256 0.87 CKS1B (0.44) MAPTALDH1A1RAB9ACKS1BSKP1
SCHEMBL8286467 0.86 PDE11A (0.44) MAPTALDH1A1LMNAPOLBGRM5
SCHEMBL8287468 0.85 P2RY12 (0.41) MAPTALDH1A1MAPK1USP2LMNA
SCHEMBL8287528 0.85 P2RY12 (0.44) MAPTALDH1A1RAB9ALMNATSHR
SCHEMBL8361778 0.85 CDK4 (0.43) ALDH1A1TSHRPDE11A
SCHEMBL8287210 0.85 PDE11A (0.43) MAPTALDH1A1RAB9AMAPK1LMNA
SCHEMBL8287946 0.83 CDK4 (0.43) ALDH1A1USP2POLBPDE11A

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
WO-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
WO-2003027112-A1 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed