SCHEMBL23436638

SCHEMBL23436638

O=[N+]([O-])c1ccccc1-c1cccc2c1oc1c2ccc2c3ccccc3n(-c3ccccc3)c21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ F2 P00734 1/20 0.39
▸ C1R P00736 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ PKM P14618 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ KLK3 P07288 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ HTRA2 O43464 1/20 0.35

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
SCHEMBL17861293 0.85 KDM4E (0.46) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL17022454 0.81 KDM4E (0.44) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL15892940 0.80 KDM4E (0.52) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL16484950 0.80 ALDH1A1 (0.55) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL17690958 0.80 L3MBTL1 (0.59) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL19045754 0.79 LMNA (0.41) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL17406611 0.79 ALDH1A1 (0.45) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL21699296 0.79 ALDH1A1 (0.48) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL16862708 0.78 MEN1 (0.43) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL16862709 0.77 TDP1 (0.42) LMNAALDH1A1MEN1KMT2AMAPT

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-11655219-B2 Organic compound, organic light emitting diode and organic light emitting device including the compound LG DISPLAY CO., LTD. (KR) 2023-05-23 — — US disclosed
US-11655219-B2 Organic compound, organic light emitting diode and organic light emitting device including the compound LG DISPLAY CO., LTD. (KR) 2023-05-23 — — US disclosed
US-20210163427-A1 ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND LG DISPLAY CO., LTD. (KR) 2021-06-03 — — 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-11655219-B2 Organic compound, organic light emitting diode and organic light emitting device including the compound OCIAD1, OCIAD2, OPRD1 LMNA 4259/4885ALDH1A1 72/4885MEN1 4484/4885
US-20210163427-A1 ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND OCIAD1, OCIAD2, OPRD1 LMNA 4259/4885ALDH1A1 72/4885MEN1 4484/4885

“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.

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