SCHEMBL18904499

SCHEMBL18904499

C(=C/c1ccc2ccc3cccnc3c2n1)\c1ccc2c3ccccc3c3ccccc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 4/20 0.44
▸ CCR8 P51685 4/20 0.44
▸ HSP90AA1 P07900 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ CCR5 P51681 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ GMNN O75496 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ THPO P40225 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ HTT P42858 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
SCHEMBL18904500 0.90 CD74 (0.42) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL13808799 0.87 MEN1 (0.39) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL18904464 0.85 MEN1 (0.36) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL31300953 0.82 KDM4E (0.57) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL17899331 0.82 CCR1 (0.67) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL18905569 0.80 MEN1 (0.32) CCR1CCR8HSP90AA1MEN1KMT2A
SCHEMBL28593931 0.78 DHFR (0.49) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL12708784 0.78 KDM4E (0.35) CCR1CCR8HSP90AA1LMNAKDM4E
SCHEMBL12954936 0.77 SMN1; SMN2 (0.47) CCR1CCR8HSP90AA1LMNACCR5
SCHEMBL12068215 0.76 KDM4E (0.57) CCR1CCR8HSP90AA1LMNACCR5

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
US-20170155055-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2017-06-01 — — US disclosed
US-20170155055-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2017-06-01 — — US disclosed
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