SCHEMBL22456525

SCHEMBL22456525

CP(=O)(c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)c1ccccc1n1c3ccc4cc(-c5ccccc5)ccc4c3nc21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.32
NR4A2 P43354 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31
TUBB6 Q9BUF5 1/20 0.31
TUBB2B Q9BVA1 1/20 0.31
TUBB1 Q9H4B7 1/20 0.31
KDM4E B2RXH2 2/20 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
SCHEMBL22456584 0.88 TSPO (0.32) TSPONR4A2TUBB4ATUBBTUBA3C
SCHEMBL22456739 0.87 ESR1 (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22456736 0.84 PTGES (0.32) TSPONR4A2RXRARXRBTUBB4A
SCHEMBL22456751 0.84 KDM4E (0.47) KDM4EALDH1A1HPGDTSHRHSD17B10
SCHEMBL22456523 0.82 TUBB4A (0.34) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22456793 0.79 KDM4E (0.49) KDM4EALDH1A1HPGDTSHRHSD17B10
SCHEMBL22456747 0.78 TUBB4A (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22456805 0.77 ALDH1A1 (0.41) RXRARXRBKDM4EALDH1A1HPGD
SCHEMBL22456536 0.75 KDM4E (0.48) KDM4EALDH1A1HPGDTSHRHSD17B10
SCHEMBL22456791 0.74 KDM4E (0.49) KDM4EALDH1A1HPGDTSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-09-24 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-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME NR2E3, NR2E1, NOX1 TSPO 2903/4885NR4A2 16/4885RXRA 153/4885

“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.