SCHEMBL24029205

SCHEMBL24029205

C1=C(c2ccccn2)CCC(c2c3ccccc3c(-c3ccc(-c4ccccn4)cc3)c3cc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)ccc23)=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.37
METAP1 P53582 1/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 3/20 0.33
RAB9A P51151 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
KLF5 Q13887 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PRMT5 O14744 2/20 0.32
WDR77 Q9BQA1 1/20 0.32
CYP2A6 P11509 1/20 0.32
NPC1 O15118 2/20 0.32
HTT P42858 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
SCHEMBL17877066 0.88 DHODH (0.45) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL25700517 0.88 DHODH (0.45) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL10030048 0.88 DHODH (0.45) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL21539737 0.86 DHODH (0.31) DHODH
SCHEMBL25454631 0.86 DHODH (0.31) DHODH
SCHEMBL10030034 0.85 DHODH (0.45) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL10300965 0.85 DHODH (0.47) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL24565242 0.85 DHODH (0.47) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL10030023 0.85 DHODH (0.47) DHODHMETAP1TSHRHSD17B10MAPK1
SCHEMBL10030053 0.85 DHODH (0.47) DHODHMETAP1TSHRHSD17B10MAPK1

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-20210359215-A1 COMPOUND AND LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-18 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-20210359215-A1 COMPOUND AND LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, SIRT1 DHODH 2072/4885METAP1 1878/4885TSHR 3821/4885

“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.