SCHEMBL23946254

SCHEMBL23946254

c1ccc(-c2cccc3c(-c4cccc5ccccc45)ncnc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.44
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TNF P01375 1/20 0.42
ADORA2A P29274 1/20 0.42
ENPP1 P22413 3/20 0.40
MEN1 O00255 2/20 0.40

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
SCHEMBL23946298 0.87 ADORA2A (0.50) LIMK1ALDH1A1KDM4EMAPTHPGD
SCHEMBL23946313 0.86 ADORA2A (0.56) LIMK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23946250 0.80 ADORA2A (0.53) LIMK1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13078943 0.80 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTHPGDTP53
SCHEMBL22639632 0.79 ADORA2A (0.46) ALDH1A1KDM4EMAPTHPGDTSHR
SCHEMBL25453847 0.78 AR (0.44) ALDH1A1MAPTHPGDTSHRMAPK1
SCHEMBL13078960 0.77 ALDH1A1 (0.45) ALDH1A1KDM4EMAPTHPGDTP53
SCHEMBL18731747 0.76 ADORA2A (0.56) LIMK1ALDH1A1KDM4EMAPTHPGD
SCHEMBL29986658 0.76 ADORA2A (0.56) LIMK1ALDH1A1KDM4EMAPTHPGD
SCHEMBL30013819 0.75 ADORA2A (0.55) LIMK1ALDH1A1KDM4EMAPTHPGD

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-20210328153-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-10-21 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-20210328153-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES IDO1, IDO2, AZI2 LIMK1 1065/4885ALDH1A1 1455/4885KDM4E 156/4885

“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.