SCHEMBL10027992

SCHEMBL10027992

COc1cccc2c1-c1ncccc1C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
PLAU P00749 1/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 1/20 0.41
SYK P43405 1/20 0.38
HTR7 P34969 1/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GRM5 P41594 1/20 0.37
ASIC3 Q9UHC3 1/20 0.37
HTR1A P08908 1/20 0.37
SLC6A2 P23975 1/20 0.37

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
SCHEMBL10028268 0.83 CYP19A1 (0.36) CYP19A1CYP11B1CYP11B2PLAUPDGFRB
SCHEMBL10000546 0.77 CYP2A6 (0.44) PLAUHTR2AHTR2CMEN1NPC1
SCHEMBL4056294 0.76 LMNA (0.41) CYP19A1MEN1NPC1LMNARAB9A
SCHEMBL13123151 0.74 ALDH1A1 (0.53) CYP19A1MEN1KMT2ACYP3A4MAPT
SCHEMBL5702570 0.73 CA1 (0.50) PLAUSYKPDGFRBPDGFRAMEN1
SCHEMBL29894839 0.73 CA1 (0.50) PLAUSYKPDGFRBPDGFRAMEN1
SCHEMBL577689 0.73 TDP1 (0.42) HTR2AHTR2CMEN1LMNAKMT2A
SCHEMBL1647356 0.73 MAPT (0.52) HTR2AHTR2CMEN1LMNARAB9A
SCHEMBL23175282 0.72 ALDH1A1 (0.48) PLAUSYKPDGFRBPDGFRAMEN1
SCHEMBL29625828 0.72 ALDH1A1 (0.48) PLAUSYKPDGFRBPDGFRAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 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 (2 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-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 CYP19A1 586/4885CYP11B1 408/4885CYP11B2 637/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 CYP19A1 586/4885CYP11B1 408/4885CYP11B2 637/4885

“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.