SCHEMBL21736053

SCHEMBL21736053

c1ccc(-n2c3ccccc3c3ccc(-c4nc(-n5c6ccccc6c6cc7ccccc7cc65)c5c(n4)oc4cc(-c6ccccn6)ccc45)cc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34
METAP2 P50579 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
RAB9A P51151 2/20 0.32
MAPT P10636 1/20 0.32
PPP1CA P62136 1/20 0.32
HIF1A Q16665 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NPY5R Q15761 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
MCL1 Q07820 1/20 0.30
AHR P35869 1/20 0.30
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21736235 0.94 AHR (0.33) NPSR1METAP2AHR
SCHEMBL20670060 0.88 SMN1; SMN2 (0.38) NPSR1L3MBTL1RAB9AKDM4EATM
SCHEMBL21736293 0.85 SMN1; SMN2 (0.38) NPSR1L3MBTL1RAB9AKDM4EATM
SCHEMBL21736051 0.84 TSHR (0.35) METAP2L3MBTL1RAB9AMAPTPPP1CA
SCHEMBL20669988 0.84 HCRTR1 (0.33) NPSR1L3MBTL1MAPTKDM4EAHR
SCHEMBL18273484 0.83 SMN1; SMN2 (0.41) NPSR1L3MBTL1RAB9AKDM4EATM
SCHEMBL21736055 0.81 SMN1; SMN2 (0.34) NPSR1L3MBTL1RAB9ANPY5RKDM4E
SCHEMBL21735901 0.80 CHEK2 (0.31) L3MBTL1SMN1; SMN2
SCHEMBL16905839 0.80 SMN1; SMN2 (0.41) NPSR1L3MBTL1RAB9AKDM4EATM
SCHEMBL20670175 0.79 NPY5R (0.34) METAP2L3MBTL1RAB9AMAPTPPP1CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530225-B2 Compound and organic light-emitting diode comprising same LG CHEM, LTD. (KR) 2022-12-20 US disclosed
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-20 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-11530225-B2 Compound and organic light-emitting diode comprising same CRY1, CRY2, TRPA1 NPSR1 4543/4885METAP2 4120/4885L3MBTL1 433/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 NPSR1 4543/4885METAP2 4120/4885L3MBTL1 433/4885

“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.