SCHEMBL20126952

SCHEMBL20126952

Cc1cc2sccc2c(C)c1C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
CYP2A6 P11509 6/20 0.35
MAPT P10636 4/20 0.35
ICAM1 P05362 1/20 0.35
SELE P16581 1/20 0.35
VCAM1 P19320 1/20 0.35
CSNK2A2 P19784 2/20 0.34
CSNK2B P67870 2/20 0.34
CSNK2A1 P68400 2/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TSHR P16473 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
SCHEMBL22504295 0.83 KDM4E (0.42) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL16449714 0.81 KDM4E (0.41) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL20146542 0.81 KDM4E (0.36) KDM4EMAPTICAM1SELEVCAM1
SCHEMBL20022330 0.81 KDM4E (0.36) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL16016838 0.78 TUBB4A (0.38) KDM4EMAPTALDH1A1TSHR
SCHEMBL18177602 0.77 KDM4E (0.39) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL26080844 0.76 KDM4E (0.42) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL22504306 0.76 MAPT (0.40) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL8404364 0.74 MAPT (0.44) KDM4ECYP2A6MAPTICAM1SELE
SCHEMBL29594290 0.73 KDM4E (0.43) KDM4ECYP2A6MAPTICAM1SELE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180130956-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-05-10 US disclosed
US-20180130956-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-05-10 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-20180130956-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES CYCS, OXA1L, ICOSLG KDM4E 1458/4885CYP2A6 3744/4885MAPT 2073/4885

“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.