SCHEMBL23972156

SCHEMBL23972156

c1ccc(-c2nccc3c2sc2ccc4cccnc4c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
CCR1 P32246 2/20 0.40
CCR5 P51681 2/20 0.40
CCR8 P51685 2/20 0.40
MMP2 P08253 2/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
MMP8 P22894 1/20 0.40
THPO P40225 1/20 0.40
MTOR P42345 1/20 0.40
HTT P42858 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
SCHEMBL31682282 0.79 MAPT (0.46) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL28413365 0.79 MAPT (0.46) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL23972178 0.77 LIMK1 (0.40) PDE3BPDE3AHTR2BHTR5ATDO2
SCHEMBL2112126 0.75 CCR1 (0.48) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL20149676 0.74 PDE3B (0.43) KDM4EMAPTCYP3A4SMN1; SMN2L3MBTL1
SCHEMBL24795852 0.73 HTR2B (0.45) KDM4EMAPTL3MBTL1PDE3BPDE3A
SCHEMBL21622486 0.73 LIMK1 (0.44) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL3138185 0.72 PDE4D (0.56) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL25461964 0.72 ALDH1A1 (0.42) KDM4ELMNAMAPTCCR1CCR5
SCHEMBL23972147 0.71 KDM4E (0.47) KDM4ELMNAMAPTCYP3A4TSHR

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-20210343950-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-11-04 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-20210343950-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES AOX1, OCIAD1, OCIAD2 KDM4E 999/4885LMNA 3946/4885MAPT 2064/4885

“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.