SCHEMBL21927488

SCHEMBL21927488

N#Cc1cccc(-c2ccccc2-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)n1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.32
AHR P35869 1/20 0.31
CTSS P25774 1/20 0.31
USP30 Q70CQ3 2/20 0.30
ADORA2A P29274 1/20 0.30
LRRK2 Q5S007 1/20 0.30

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
SCHEMBL21927684 0.96 PIM1 (0.32) PIM1AHRCTSSUSP30ADORA2A
SCHEMBL21928309 0.91 CTSS (0.36) CTSSUSP30
SCHEMBL21927386 0.88 CTSS (0.36) CTSSUSP30
SCHEMBL21928085 0.84 DUSP3 (0.37) PIM1AHRCTSSADORA2ALRRK2
SCHEMBL21927372 0.83 CTSS (0.39) AHRCTSSUSP30
SCHEMBL21927428 0.82 LRRK2 (0.34) PIM1USP30LRRK2
SCHEMBL21928334 0.82 DUSP3 (0.33) ADORA2ALRRK2
SCHEMBL21927395 0.82 LRRK2 (0.34) PIM1USP30LRRK2
SCHEMBL18589635 0.81 AHR (0.42) AHR
SCHEMBL18589575 0.81 AHR (0.42) AHR

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-20200131150-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., 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-20200131150-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CCNT1, CCNA1, CCNE2 PIM1 3696/4885AHR 1575/4885CTSS 2917/4885

“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.