SCHEMBL22472579

SCHEMBL22472579

c1ccc2c(c1)Cc1nccnc1S2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALOX15 P16050 1/20 0.34
MAPK10 P53779 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC6 Q9UBN7 1/20 0.31
METAP2 P50579 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
SCHEMBL8146101 0.79 ALDH1A1 (0.46) HPGDKDM4EMAPTALDH1A1MEN1
SCHEMBL22472602 0.79 ALDH1A1 (0.45) HPGDKDM4EMAPTGAASMN1; SMN2
SCHEMBL26535675 0.73 MAPT (0.55) HPGDKDM4EMAPTGAASMN1; SMN2
SCHEMBL11324372 0.72 ALDH1A1 (0.45) HPGDKDM4EMAPTGAASMN1; SMN2
SCHEMBL655964 0.71 ALDH1A1 (0.63) HPGDKDM4EMAPTGAAALDH1A1
Thioxanthene SCHEMBL8717 0.70 ALDH1A1 (0.61) HPGDKDM4EMAPTGAAALDH1A1
Thioxanthene SCHEMBL29398766 0.70 ALDH1A1 (0.61) HPGDKDM4EMAPTGAAALDH1A1
SCHEMBL23504073 0.69
SCHEMBL18311802 0.68 ALDH1A1 (0.59) HPGDKDM4EMAPTGAAALDH1A1
Thioxanthene SCHEMBL31106427 0.68 ALDH1A1 (0.59) HPGDKDM4EMAPTGAAALDH1A1

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-10790455-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-09-29 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-10790455-B2 Organic electroluminescent materials and devices ORC3, ALKBH2, ENPP3 HPGD 2172/4885KDM4E 1498/4885MAPT 3023/4885

“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.