SCHEMBL12320089

SCHEMBL12320089

Cc1cccnc1-c1c(C)cccc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.54
NOS1 P29475 1/20 0.54
NOS2 P35228 1/20 0.54
CYP2A6 P11509 1/20 0.53
PDK2 Q15119 1/20 0.50
METAP2 P50579 1/20 0.48
PLAU P00749 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41
CNR2 P34972 1/20 0.40
TGFBR1 P36897 1/20 0.40
NPC1 O15118 2/20 0.39
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
TDP2 O95551 1/20 0.38
NSD2 O96028 1/20 0.38
ABL1 P00519 1/20 0.38
PLCG1 P19174 1/20 0.38

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
SCHEMBL29924154 0.85 CYP2A6 (0.61) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL196235 0.85 CYP2A6 (0.61) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL31252534 0.85 CYP2A6 (0.61) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL12320090 0.85 CYP2A6 (0.48) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL2642064 0.85 NOS3 (0.54) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL31175943 0.83 CYP2A6 (0.47) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL4159050 0.82 CYP2A6 (0.43) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL17589450 0.82 CYP2A6 (0.50) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL12319853 0.81 CYP2A6 (0.46) NOS3NOS1NOS2CYP2A6PDK2
SCHEMBL17014652 0.81 CYP2A6 (0.50) NOS3NOS1NOS2CYP2A6PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-26 US disclosed
US-11746122-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-09-05 US disclosed
US-11737349-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-08-22 US disclosed
US-20230263049-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-08-17 US disclosed
US-20230147066-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-05-11 US disclosed
US-9847497-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-12-19 US disclosed
US-20150236279-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2015-08-20 US disclosed
US-8017774-B2 Producing method for iridium complex CANON KABUSHIKI KAISHA (JP) 2011-09-13 US disclosed
US-20070232803-A1 PRODUCING METHOD FOR IRIDIUM COMPLEX CANON KABUSHIKI KAISHA (JP) 2007-10-04 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 (7 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-20150236279-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES MLX, ZYX, LOXL1 NOS3 1807/4885NOS1 2366/4885NOS2 2839/4885
US-11746122-B2 Organic electroluminescent materials and devices GLRA3, GLRA2, LIFR NOS3 2003/4885NOS1 3259/4885NOS2 2862/4885
US-11737349-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, OTC NOS3 1755/4885NOS1 1374/4885NOS2 1621/4885
US-20230147066-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, SSB, MCOLN3 NOS3 1273/4885NOS1 2270/4885NOS2 2568/4885
US-20070232803-A1 PRODUCING METHOD FOR IRIDIUM COMPLEX LAGE3, EML4, INTS9 NOS3 2606/4885NOS1 2030/4885NOS2 1281/4885
US-20230263049-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OSBPL3, OCIAD1, OSBP NOS3 904/4885NOS1 1950/4885NOS2 2000/4885
US-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OPRD1, L1CAM, OPRM1 NOS3 2364/4885NOS1 3055/4885NOS2 3504/4885

“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.