SCHEMBL3788007

SCHEMBL3788007

Cc1ccnc2c3ccccc3c3ccccc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.50
CCR8 P51685 3/20 0.50
CCR5 P51681 2/20 0.50
PSMD14 O00487 2/20 0.48
COPS5 Q92905 2/20 0.48
L3MBTL1 Q9Y468 4/20 0.43
NPC1 O15118 1/20 0.43
HSP90AA1 P07900 1/20 0.43
CYP2A6 P11509 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTT P42858 3/20 0.40
SLC6A2 P23975 1/20 0.40
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 2/20 0.35

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
SCHEMBL24858850 0.90 PSMD14 (0.49) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL16919884 0.88 L3MBTL1 (0.50) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL17007533 0.84 L3MBTL1 (0.50) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL10001035 0.84 L3MBTL1 (0.45) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL17007526 0.82 L3MBTL1 (0.48) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL27255132 0.79 CCR1 (0.42) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL21298321 0.78 HSP90AA1 (0.50) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL17007529 0.78 L3MBTL1 (0.52) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL1007693 0.77 TLR7 (0.49) ADRA1DADRA1AALDH1A1CYP1A2POLB
SCHEMBL21298320 0.76 HSP90AA1 (0.48) CCR1CCR8CCR5PSMD14COPS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8753756-B2 Green phosphorescent iridium complexes, fabrication method thereof and organic light-emitting diodes comprising the same Cheng, Chien-Hong (TW) 2014-06-17 US disclosed
US-8753756-B2 Green phosphorescent iridium complexes, fabrication method thereof and organic light-emitting diodes comprising the same Cheng, Chien-Hong (TW) 2014-06-17 US disclosed
US-8753756-B2 Green phosphorescent iridium complexes, fabrication method thereof and organic light-emitting diodes comprising the same Cheng, Chien-Hong (TW) 2014-06-17 US disclosed
US-20100327736-A1 GREEN PHOSPHORESCENT IRIDIUM COMPLEXES, FABRICATION METHOD THEREOF AND ORGANIC LIGHT-EMITTING DIODES COMPRISING THE SAME Cheng, Chien-Hong (TW) 2010-12-30 US disclosed
US-20100327736-A1 GREEN PHOSPHORESCENT IRIDIUM COMPLEXES, FABRICATION METHOD THEREOF AND ORGANIC LIGHT-EMITTING DIODES COMPRISING THE SAME Cheng, Chien-Hong (TW) 2010-12-30 US disclosed
US-20100327736-A1 GREEN PHOSPHORESCENT IRIDIUM COMPLEXES, FABRICATION METHOD THEREOF AND ORGANIC LIGHT-EMITTING DIODES COMPRISING THE SAME Cheng, Chien-Hong (TW) 2010-12-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100327736-A1 GREEN PHOSPHORESCENT IRIDIUM COMPLEXES, FABRICATION METHOD THEREOF AND ORGANIC LIGHT-EMITTING DIODES COMPRISING THE SAME IK, INTS6, NR2E3 CCR1 1024/4885CCR8 2798/4885CCR5 325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.