SCHEMBL8302500

SCHEMBL8302500

O=C(Cc1ccc2ccc(Cl)cc2n1)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.51
NPC1 O15118 6/20 0.51
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.46
GSK3B P49841 2/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR2 P34972 1/20 0.41
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
MGAM O43451 1/20 0.40
AMY1A P0DUB6 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
PABPC1 P11940 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
SCHEMBL8301183 0.89 RAB9A (0.50) RAB9ANPC1L3MBTL1MAPTGSK3B
SCHEMBL7809623 0.74 S1PR4 (0.49) KMT2A
SCHEMBL9993146 0.74 RAB9A (0.67) RAB9ANPC1L3MBTL1MAPTGSK3B
SCHEMBL3252516 0.73 RAB9A (0.60) RAB9ANPC1L3MBTL1MAPTGSK3B
SCHEMBL28197583 0.72 CYP1A2 (0.59) RAB9ANPC1L3MBTL1MAPTKDM4E
SCHEMBL8303468 0.72 NPC1 (0.55) RAB9ANPC1L3MBTL1MAPTGSK3B
SCHEMBL3276372 0.72 NR4A2 (0.47) MAPTKMT2A
SCHEMBL4720632 0.71 HDAC1 (0.51) RAB9AMAPTKDM4EMEN1ALDH1A1
SCHEMBL8183037 0.71 PGK1 (0.50)
SCHEMBL5445089 0.71 LTB4R (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508469-B1 3,4,N-Trisubstituted-4,5-dihydro-1H-pyrazole-1-carboxamides and their use as insecticides DOWELANCO (US) 1999-03-03 EP disclosed
US-5493024-A 1,2-DIARYL-2-PROPEN-1-ONE CHEMICAL INTERMEDIATE COMPOUND DOWELANCO (US) 1996-02-20 US disclosed
US-5324837-A 3,4-disubstituted-4,5-dihydro-1H-pyrazoles and a method of preparation DOWELANCO (US) 1994-06-28 US disclosed
US-5250532-A Moths. termites DOWELANCO (US) 1993-10-05 US disclosed
EP-0508469-A1 3,4,N-Trisubstituted-4,5-dihydro-1H-pyrazole-1-carboxamides and their use as insecticides DOWELANCO (US) 1992-10-14 EP disclosed