SCHEMBL7590766

SCHEMBL7590766

CCCCCCCOc1ccnc2ccccc12

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 3/20 0.51
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ FAAH O00519 1/20 0.47
▸ MGLL Q99685 1/20 0.47
▸ CNR1 P21554 2/20 0.46
▸ CNR2 P34972 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ S1PR2 O95136 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ NCF1 P14598 2/20 0.45
▸ NR1I2 O75469 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ HTR2B P41595 1/20 0.44

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
SCHEMBL7561580 0.98 TLR8 (0.50) TLR8MEN1KMT2AHTTFAAH
SCHEMBL16836384 0.93 TLR8 (0.49) TLR8CNR1CNR2LMNANCF1
SCHEMBL2333830 0.92 NCF1 (0.51) NCF1HDAC6HTR1AADRA1DADRA1A
SCHEMBL10950611 0.89 NCF1 (0.51) TLR8MEN1KMT2ACNR1CNR2
SCHEMBL10945765 0.89 NCF1 (0.51) TLR8MEN1KMT2ACNR1CNR2
SCHEMBL19938062 0.88 TLR8 (0.47) TLR8MEN1KMT2ACNR1CNR2
SCHEMBL21834887 0.84 CNR2 (0.47) KMT2AHTTCNR1CNR2LMNA
SCHEMBL21834885 0.84 CNR2 (0.47) KMT2AHTTCNR1CNR2LMNA
SCHEMBL27530219 0.83 TLR8 (0.41) TLR8MEN1KMT2AHTTCNR1
SCHEMBL23716938 0.82 CNR2 (0.46) TLR8KMT2AHTTCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326331-B1 Substituted quinolines and cinnolines DOW AGROSCIENCES LLC (US) 2002-04-17 — — EP disclosed
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