SCHEMBL22011437

SCHEMBL22011437

Ic1cc2ccc3sc4ccccc4c3c2c2c1sc1ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
MAPT P10636 7/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
DUSP3 P51452 1/20 0.36
BLM P54132 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
MCL1 Q07820 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
RAB9A P51151 4/20 0.34
HPGD P15428 3/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 3/20 0.34

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
SCHEMBL24614818 0.89 GPR3 (0.41) GPR3MAPTMEN1KMT2APOLB
SCHEMBL25812743 0.81 MAPT (0.42) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL24614734 0.81 PTPN1 (0.42) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL24614819 0.80 MAPT (0.41) GPR3MAPTMEN1KMT2APOLB
SCHEMBL22011950 0.80 GPR3 (0.48) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL22011430 0.79 GPR3 (0.41) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL19109232 0.79 GPR3 (0.56) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL30899154 0.79 GPR3 (0.56) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL30899153 0.79 GPR3 (0.56) GPR3MAPTMEN1KMT2ATDP1
SCHEMBL24172204 0.79 MAPT (0.40) GPR3MAPTMEN1KMT2ATDP1

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 6 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-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-07-14 US 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 (3 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-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES TMEM109, PIEZO1, L1CAM GPR3 4195/4885MAPT 2260/4885MEN1 126/4885
US-20220006030-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES ZYX, RER1, AOC2 GPR3 2982/4885MAPT 4261/4885MEN1 1681/4885
US-12035625-B2 Materials for organic electroluminescent devices ZYX, RER1, AOC2 GPR3 2982/4885MAPT 4261/4885MEN1 1681/4885

“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.