SCHEMBL21736067

SCHEMBL21736067

c1ccc(-c2ccc(-c3cc4c(cc3-c3ccccc3)sc3c(-n5c6ccccc6c6cc7ccccc7cc65)nc(-c5ccncc5)nc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 9/20 0.39
PIK3CA P42336 1/20 0.37
TSHR P16473 4/20 0.33
USP2 O75604 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 5/20 0.32
MAPT P10636 5/20 0.32
IMPDH2 P12268 1/20 0.32
ALDH1A1 P00352 4/20 0.32
HPGD P15428 2/20 0.32
HIF1A Q16665 1/20 0.32
MAPK1 P28482 2/20 0.31
HTT P42858 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL21736072 0.89 PRKCI (0.42) PRKCIPIK3CATSHRUSP2MEN1
SCHEMBL21736532 0.82 PIM1 (0.44) PRKCIPIK3CATSHRUSP2MEN1
SCHEMBL26743206 0.81 KDM4E (0.37) PRKCIPIK3CAKDM4E
SCHEMBL26743177 0.80 KDM4E (0.36) PRKCIPIK3CAKDM4E
SCHEMBL21735881 0.80 HTR2C (0.35) PRKCIPIK3CATSHRCYP1A2CYP3A4
SCHEMBL20670235 0.80 PIK3CA (0.34) PIK3CATSHRUSP2MEN1KMT2A
SCHEMBL26743501 0.80 PRKCI (0.33) PRKCIPIK3CA
SCHEMBL20670173 0.79 LIMK1 (0.37) PIK3CAKDM4E
SCHEMBL25147176 0.78 L3MBTL1 (0.40) PRKCIPIK3CATSHRMEN1KMT2A
SCHEMBL21736036 0.78 GBA1 (0.39) PRKCIPIK3CATSHRUSP2MEN1

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 PRKCI 4614/4885PIK3CA 4634/4885TSHR 4719/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 PRKCI 4614/4885PIK3CA 4634/4885TSHR 4719/4885

“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.