SCHEMBL22012010

SCHEMBL22012010

c1ccc2c(c1)sc1c3sc4ccccc4c3c3c4c5ccccc5sc4c4sc5ccccc5c4c3c21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.57
TNKS O95271 2/20 0.50
TNKS2 Q9H2K2 2/20 0.50
MAPT P10636 3/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAP3K9 P80192 3/20 0.45
MAP3K11 Q16584 3/20 0.45
PTPN1 P18031 1/20 0.45
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45
LIMK1 P53667 1/20 0.42
CDK5 Q00535 1/20 0.42
CDK5R1 Q15078 1/20 0.42
ALDH1A1 P00352 4/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NTRK1 P04629 1/20 0.40
MAP3K10 Q02779 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
SCHEMBL19109094 0.90 GPR3 (0.57) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL17689841 0.90 GPR3 (0.57) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL17010959 0.86 GPR3 (0.60) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL12270422 0.85 GPR3 (0.43) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL12270540 0.81 GPR3 (0.43) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL29700327 0.80 GPR3 (0.67) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL430470 0.80 GPR3 (0.67) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL19267448 0.80 GPR3 (0.52) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL1295178 0.80 GPR3 (0.52) GPR3TNKSTNKS2MAPTRAB9A
SCHEMBL1534030 0.80 GPR3 (0.46) GPR3TNKSTNKS2MAPTRAB9A

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 2982/4885TNKS 3801/4885TNKS2 2931/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 GPR3 2982/4885TNKS 3801/4885TNKS2 2931/4885

“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.