SCHEMBL3846601

SCHEMBL3846601

Cc1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1-c1ccc2nccc(N3CCN(C(=O)Nc4ccccc4)CC3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 0.51
KDM4E B2RXH2 3/20 0.45
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 1/20 0.45
FAAH O00519 1/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.42
RBP4 P02753 1/20 0.41
GOT1 P17174 1/20 0.41

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
SCHEMBL3848420 0.90 DRD2 (0.42) PDGFRBKDM4EMAPTMAPK1
SCHEMBL3846078 0.88 PDGFRB (0.39) PDGFRBKDM4EMAPTMAPK1
SCHEMBL3849677 0.87 MEN1 (0.41) PDGFRBKDM4EMAPTMAPK1
SCHEMBL3846241 0.86 DRD2 (0.43) PDGFRBKDM4EMAPTMAPK1
SCHEMBL3846433 0.86 AKR1C3 (0.42) PDGFRBKDM4EMAPTMAPK1GAA
SCHEMBL3848852 0.84 ALDH1A1 (0.43) KDM4EMAPK1
SCHEMBL3846765 0.83 ALDH1A1 (0.44) PDGFRBKDM4EMAPTFAAHMAPK1
SCHEMBL3848411 0.83 PIK3CA (0.37) PDGFRB
SCHEMBL3846609 0.83 MTOR (0.37) PDGFRBKDM4EMAPTMAPK1
SCHEMBL3846957 0.82 NCF1 (0.48)

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-2048142-A2 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed
EP-1382603-B1 NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF EISAI R&D MAN CO LTD (JP) 2008-07-23 EP disclosed
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP disclosed