SCHEMBL442331

SCHEMBL442331

Clc1nccc2c1sc1ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.46
MAPT P10636 5/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
APEX1 P27695 1/20 0.44
MAPK1 P28482 1/20 0.44
PMP22 Q01453 1/20 0.44
LIMK1 P53667 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.38
ALOX5 P09917 1/20 0.37
RAB9A P51151 5/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL30967228 1.00 GPR3 (0.46) GPR3MAPTLMNACYP3A4APEX1
SCHEMBL20137415 0.80 MAPT (0.44) MAPTLMNACYP3A4APEX1MAPK1
SCHEMBL25171509 0.79 BCKDK (0.39) MAPTLMNACYP3A4APEX1MAPK1
SCHEMBL25569972 0.78 CYP3A4 (0.54) MAPTLMNACYP3A4APEX1MAPK1
SCHEMBL22362535 0.78 GPR3 (0.46) GPR3MAPTLIMK1CDK5CDK5R1
SCHEMBL26873059 0.78 GPR3 (0.46) GPR3MAPTLIMK1CDK5CDK5R1
SCHEMBL24188602 0.78 GPR3 (0.46) GPR3MAPTLMNALIMK1CDK5
SCHEMBL24445388 0.78 MAPT (0.41) MAPTLMNACYP3A4APEX1MAPK1
SCHEMBL15747037 0.78 MAPT (0.56) GPR3MAPTLMNACYP3A4APEX1
SCHEMBL11941220 0.76 GPR3 (0.45) GPR3MAPTLIMK1CDK5CDK5R1

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834459-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-12-05 US disclosed
US-11834459-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-12-05 US disclosed
US-11834459-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-12-05 US disclosed
US-20230389413-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2023-11-30 US disclosed
US-20230389413-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2023-11-30 US disclosed
US-20230389413-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2023-11-30 US disclosed
US-11758807-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION 2023-09-12 US disclosed
US-11758807-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION 2023-09-12 US disclosed
US-11758807-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION 2023-09-12 US disclosed
US-20230157159-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-05-18 US disclosed
US-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2012-03-15 US disclosed
EP-2387576-A2 NEW MATERIALS WITH AZA-DIBENZOTHIOPHENE OR AZA-DIBENZOFURAN CORE FOR PHOLED Universal Display Corporation (US) 2011-11-23 EP disclosed
WO-2011137072-A1 BICARBAZOLE CONTAINING COMPOUNDS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2011-11-03 WO disclosed
WO-2011137072-A1 BICARBAZOLE CONTAINING COMPOUNDS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2011-11-03 WO disclosed
US-20110260138-A1 BICARBZOLE CONTAINING COMPOUNDS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2011-10-27 US disclosed
US-20110260138-A1 BICARBZOLE CONTAINING COMPOUNDS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2011-10-27 US disclosed
US-20110260138-A1 BICARBZOLE CONTAINING COMPOUNDS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2011-10-27 US disclosed
WO-2010118029-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2010-10-14 WO disclosed
US-20100187984-A1 MATERIALS WITH AZA-DIBENZOTHIOPHENE OR AZA-DIBENZOFURAN CORE FOR PHOLED UNIVERSAL DISPLAY CORPORATION (US) 2010-07-29 US disclosed
WO-2010083359-A2 NEW MATERIALS WITH AZA-DIBENZOTHIOPHENE OR AZA-DIBENZOFURAN CORE FOR PHOLED UNIVERSAL DISPLAY CORPORATION (US) 2010-07-22 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 (7 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-20230389413-A1 Organic Electroluminescent Materials and Devices GLRA3, ESRRG, GLRA1 GPR3 46/4885MAPT 4879/4885LMNA 2206/4885
US-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES ZFX, VDAC1, PDCD1LG2 GPR3 3470/4885MAPT 2467/4885LMNA 4488/4885
US-20230157159-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME NR0B1, AHR, ARL1 GPR3 1000/4885MAPT 3551/4885LMNA 706/4885
US-11834459-B2 Host materials for electroluminescent devices RPS4X, MLX, RPS4Y1 GPR3 1403/4885MAPT 4880/4885LMNA 1552/4885
US-20110260138-A1 BICARBZOLE CONTAINING COMPOUNDS FOR OLEDS OCIAD1, OCIAD2, BRD7 GPR3 1107/4885MAPT 1406/4885LMNA 4550/4885
US-20100187984-A1 MATERIALS WITH AZA-DIBENZOTHIOPHENE OR AZA-DIBENZOFURAN CORE FOR PHOLED DDT, FZD7, BRD7 GPR3 4580/4885MAPT 1289/4885LMNA 4455/4885
US-11758807-B2 Organic electroluminescent materials and devices GLRA3, ESRRG, GLRA1 GPR3 46/4885MAPT 4879/4885LMNA 2206/4885

“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.