SCHEMBL22956090

SCHEMBL22956090

c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3cccc(-c4c5ccccc5c(-c5cccc(-c6ccncc6)c5)c5ccccc45)c3)c(-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.56
MKNK1 Q9BUB5 1/20 0.50
IMPDH2 P12268 3/20 0.47
PIK3CA P42336 1/20 0.45
PRKCI P41743 1/20 0.44
KIF11 P52732 1/20 0.44
MAPK14 Q16539 2/20 0.43
MAPK13 O15264 1/20 0.43
GCGR P47871 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
CHEK1 O14757 3/20 0.43
PRMT6 Q96LA8 1/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ATAD2 Q6PL18 1/20 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
SCHEMBL24662784 0.98 NOTUM (0.58) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL10030090 0.94 NOTUM (0.52) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL18810931 0.94 NOTUM (0.56) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL22955778 0.91 IMPDH2 (0.51) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL21240010 0.91 IMPDH2 (0.48) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL30386196 0.91 IMPDH2 (0.48) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL22955779 0.91 IMPDH2 (0.48) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL13820530 0.90 NOTUM (0.48) NOTUMMKNK1IMPDH2PIK3CAPRKCI
SCHEMBL13016360 0.90 HSD17B1 (0.50) NOTUMMKNK1IMPDH2PIK3CAMAPK14
SCHEMBL10030030 0.89 NOTUM (0.52) NOTUMMKNK1IMPDH2PIK3CAPRKCI

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-20210036230-A1 Organic Material for an Electronic Optoelectronic Device and Electronic Device Comprising the Organic Material NOVALED GMBH (DE) 2021-02-04 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-20210036230-A1 Organic Material for an Electronic Optoelectronic Device and Electronic Device Comprising the Organic Material OCIAD1, OCIAD2, OR10J3 NOTUM 1226/4885MKNK1 1825/4885IMPDH2 1257/4885

“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.