SCHEMBL13870948

SCHEMBL13870948

CCc1cc2ccc(-c3cccc(C)c3)nc2cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.42
XDH P47989 1/20 0.40
GRM2 Q14416 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
HEXA P06865 1/20 0.39
HEXB P07686 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HSP90AA1 P07900 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
IDO1 P14902 1/20 0.38
METAP2 P50579 1/20 0.38
KMT2A Q03164 3/20 0.38
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 2/20 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
SCHEMBL13870949 0.87 KMT2A (0.36) HEXAHEXBALDH1A1NPSR1HPGD
SCHEMBL13870889 0.85 BCHE (0.44) KMOXDHBCHEACHEIDO1
SCHEMBL13870960 0.84 MAP4K4 (0.45) ALDH1A1LMNAHPGDKMT2ARAB9A
SCHEMBL13870961 0.82 NPC1 (0.44) CTSKALDH1A1LMNATHRBHPGD
SCHEMBL16487825 0.82 SMN1; SMN2 (0.44) KMOGRM2ALDH1A1LMNANPSR1
SCHEMBL13399560 0.79 BCHE (0.40) KMOXDHBCHEACHEIDO1
SCHEMBL13870959 0.78 KMT2A (0.43) ALDH1A1NPSR1HPGDKMT2AKDM4E
SCHEMBL13870957 0.78 KMT2A (0.41) ALDH1A1LMNANPSR1HPGDKMT2A
SCHEMBL4859835 0.78 CYP1A2 (0.52) KMOXDHBCHEACHEALDH1A1
SCHEMBL30486824 0.78 CYP1A2 (0.52) KMOXDHBCHEACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956737-B2 Red phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2015-02-17 US disclosed
US-8956737-B2 Red phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2015-02-17 US disclosed
US-20090085476-A1 RED PHOSPHORESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME LG DISPLAY CO., LTD. (KR) 2009-04-02 US disclosed
US-20090085476-A1 RED PHOSPHORESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME LG DISPLAY CO., LTD. (KR) 2009-04-02 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-20090085476-A1 RED PHOSPHORESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IK, G6PD, EYA2 KMO 4739/4885XDH 1754/4885GRM2 3419/4885

“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.