Sugi Predict

Sugi Predict / Compounds / SCHEMBL20129516

SCHEMBL20129516

SCHEMBL20129516

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2cccc(-c3nc(-c5ccccc5)nc(-c5ccccc5)n3)c2)sc2ccccc24)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIM3 Q86V86 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.32
▸ LIMK1 P53667 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ADORA2A P29274 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ GPR3 P46089 1/20 0.30
▸ ABCG2 Q9UNQ0 3/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ PTGER4 P35408 1/20 0.30

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
SCHEMBL18505497 0.96 PIM3 (0.34) PIM3PDE10ALIMK1KDM4EATM
SCHEMBL25662502 0.95 KDM4E (0.35) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL24217399 0.94 KDM4E (0.37) PIM3PDE10AKDM4EATML3MBTL1
SCHEMBL23595032 0.94 KDM4E (0.37) PIM3PDE10AKDM4EATML3MBTL1
SCHEMBL25660306 0.94 ALDH1A1 (0.33) PIM3PDE10ALIMK1KDM4EATM
SCHEMBL24217398 0.94 KDM4E (0.36) PIM3PDE10AKDM4EATML3MBTL1
SCHEMBL21128860 0.93 PIM3 (0.36) PIM3PDE10ALIMK1KDM4EATM
SCHEMBL21128947 0.93 PIM3 (0.36) PIM3PDE10ALIMK1KDM4EATM
SCHEMBL22249978 0.93 KDM4E (0.34) PIM3PDE10AKDM4EATML3MBTL1
SCHEMBL24221902 0.93 PIM3 (0.34) PIM3PDE10ALIMK1KDM4EATM

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-10651396-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2020-05-12 — — US disclosed
US-20180130953-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-10 — — US disclosed
US-20180130953-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-10 — — 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-10651396-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same AOX1, OCIAD1, OCIAD2 PIM3 1612/4885PDE10A 4504/4885LIMK1 303/4885
US-20180130953-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME AOX1, OCIAD1, OCIAD2 PIM3 1612/4885PDE10A 4504/4885LIMK1 303/4885

“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.