SCHEMBL22011944

SCHEMBL22011944

c1ccc2c(c1)sc1cc3sc4ccc5ccc6sc7ccccc7c6c5c4c3cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.48
MAPT P10636 7/20 0.44
ALDH1A1 P00352 5/20 0.44
RAB9A P51151 3/20 0.44
HPGD P15428 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 3/20 0.39
POLB P06746 2/20 0.39
DUSP3 P51452 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MEN1 O00255 1/20 0.39
BLM P54132 1/20 0.39
PTPN5 P54829 1/20 0.39
KMT2A Q03164 1/20 0.39
PTPN11 Q06124 1/20 0.39
MCL1 Q07820 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
CYP1A2 P05177 2/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL24171817 0.93 GPR3 (0.52) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL30899153 0.87 GPR3 (0.56) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL19109232 0.87 GPR3 (0.56) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL30899154 0.87 GPR3 (0.56) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL18666049 0.84 GPR3 (0.50) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL19110326 0.82 MAPT (0.41) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL1636952 0.81 GPR3 (0.74) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL17228825 0.81 GPR3 (0.50) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL22011945 0.81 GPR3 (0.50) GPR3MAPTALDH1A1RAB9AHPGD
SCHEMBL19109075 0.81 GPR3 (0.50) GPR3MAPTALDH1A1RAB9AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-12035625-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
EP-3880682-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed
US-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-01-06 US disclosed
WO-2020099307-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-05-22 WO 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 (2 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-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES ZYX, RER1, AOC2 GPR3 2982/4885MAPT 4261/4885ALDH1A1 1119/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 GPR3 2982/4885MAPT 4261/4885ALDH1A1 1119/4885

“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.