SCHEMBL21924418

SCHEMBL21924418

c1ccc(-c2ccc3c(c2)c2cc4ccccc4cc2n3-c2nc(-c3cccc4c3sc3ccccc34)nc3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.38
CYP1A2 P05177 5/20 0.33
CYP3A4 P08684 5/20 0.33
CYP2D6 P10635 5/20 0.33
TSHR P16473 4/20 0.33
TP53 P04637 2/20 0.33
ATR Q13535 1/20 0.33
PIM3 Q86V86 1/20 0.33
ABCG2 Q9UNQ0 4/20 0.32
CLK4 Q9HAZ1 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ACP1 P24666 2/20 0.32
MAPK1 P28482 2/20 0.32
LMNA P02545 1/20 0.32
USP2 O75604 1/20 0.32

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
SCHEMBL21213671 0.93 ALOX5 (0.36) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21212995 0.92 ALOX5 (0.38) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21213585 0.91 ALOX5 (0.36) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL16785814 0.87 ALOX5 (0.38) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21213211 0.86 ALOX5 (0.42) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21717670 0.85 ALOX5 (0.34) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21923808 0.83 ALOX5 (0.36) ALOX5PIM3LIMK1TNKSTNKS2
SCHEMBL21717465 0.83 ALOX5 (0.35) ALOX5CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21924185 0.82 ACP1 (0.47) CYP1A2CYP3A4CYP2D6TSHRTP53
SCHEMBL21923636 0.82 ACP1 (0.47) CYP1A2CYP3A4CYP2D6TSHRTP53

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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-04-30 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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1B1, CYP2C9, CYP1A1 ALOX5 617/4885CYP1A2 9/4885CYP3A4 6/4885

“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.