SCHEMBL12320135

SCHEMBL12320135

Cc1ccccc1Nc1ccccc1Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
GAA P10253 4/20 0.52
TDP1 Q9NUW8 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 2/20 0.52
GLA P06280 1/20 0.52
RECQL P46063 1/20 0.52
FABP4 P15090 1/20 0.52
ALDH1A1 P00352 3/20 0.50
SLC2A1 P11166 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HPGD P15428 2/20 0.48
HSD17B10 Q99714 3/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL304152 0.95 MAPT (0.56) MAPTGAATDP1MEN1KMT2A
SCHEMBL5697158 0.91 HPGD (0.60) MAPTGAATDP1MEN1KMT2A
SCHEMBL29940926 0.91 HPGD (0.60) MAPTGAATDP1MEN1KMT2A
SCHEMBL23369883 0.90 MEN1 (0.52) MAPTGAATDP1MEN1KMT2A
SCHEMBL29653984 0.88 MAPT (0.54) MAPTGAATDP1MEN1KMT2A
SCHEMBL108882 0.88 MAPT (0.54) MAPTGAATDP1MEN1KMT2A
SCHEMBL1713041 0.88 HTT (0.56) MAPTGAATDP1MEN1KMT2A
SCHEMBL29511793 0.85 HTT (0.59) MAPTGAATDP1MEN1KMT2A
SCHEMBL183017 0.85 HTT (0.59) MAPTGAATDP1MEN1KMT2A
SCHEMBL29011651 0.84 GAA (0.46) MAPTGAATDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2991997-B1 TRANSITION METAL COMPLEXES WITH CARBENE LIGANDS AND THE USE THEREOF IN OLEDS UDC IRELAND LTD (IE) 2018-02-21 EP disclosed
EP-3027629-B1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-06-14 EP disclosed
US-8017774-B2 Producing method for iridium complex CANON KABUSHIKI KAISHA (JP) 2011-09-13 US disclosed
WO-2010037667-A1 COMPLEX SALTS BASF SE (DE) 2010-04-08 WO 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 (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-20070232803-A1 PRODUCING METHOD FOR IRIDIUM COMPLEX LAGE3, EML4, INTS9 MAPT 1110/4885GAA 3056/4885TDP1 3495/4885

“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.