SCHEMBL23770394

SCHEMBL23770394

CC1(C)c2ccccc2-c2c(-c3nc(-c4ccc(-c5cccc(C#N)c5)cc4)nc(-c4cccc(-c5ccc6sc7ccccc7c6c5)c4)n3)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 8/20 0.40
CYP3A4 P08684 7/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
LMNA P02545 5/20 0.40
CYP2D6 P10635 5/20 0.40
ALDH1A1 P00352 4/20 0.40
CLK4 Q9HAZ1 4/20 0.40
HSD17B10 Q99714 4/20 0.40
CYP2C19 P33261 3/20 0.40
TSHR P16473 3/20 0.40
CYP2C9 P11712 2/20 0.40
MAPK1 P28482 3/20 0.38
PGR P06401 2/20 0.37
PDK2 Q15119 1/20 0.36
TP53 P04637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
ADORA2A P29274 5/20 0.35
ADORA1 P30542 3/20 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
SCHEMBL23770505 0.89 PIM3 (0.36) CYP1A2ADORA2AADORA1
SCHEMBL18463594 0.89 PIM3 (0.33) CYP1A2ALDH1A1MAPT
SCHEMBL22987011 0.88 SLC9A1 (0.34) CYP1A2ALDH1A1MAPTADORA2AADORA1
SCHEMBL19039172 0.85 PIM3 (0.33) CYP1A2MEN1KMT2ALMNAALDH1A1
SCHEMBL23770398 0.85 F9 (0.33) ALDH1A1MAPTBACE1HPGD
SCHEMBL23770461 0.85 PDK2 (0.36) CYP1A2CYP3A4MEN1KMT2ACYP2D6
SCHEMBL23770519 0.85 ALOX5 (0.40) CYP1A2CYP3A4MEN1KMT2ALMNA
SCHEMBL23770501 0.85 ALOX5 (0.39)
SCHEMBL22352501 0.84 PIM3 (0.31)
SCHEMBL20465226 0.83 ALDH1A1 (0.33) ALDH1A1MAPTHPGD

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-20230123170-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND IDEMITSU KOSAN CO.,LTD. (JP) 2023-04-20 US disclosed
WO-2021162122-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2021-08-19 WO 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-20230123170-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND L1CAM, LEF1, CCNL2 CYP1A2 686/4885CYP3A4 672/4885MEN1 159/4885

“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.