SCHEMBL1059025

SCHEMBL1059025

CC(c1ccccc1)(c1ccccc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALOX15 P16050 1/20 0.39
RIPK1 Q13546 2/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CYP3A4 P08684 1/20 0.38
KCNN4 O15554 2/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
AOC3 Q16853 1/20 0.36
CACNA1F O60840 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
ADRA2B P18089 1/20 0.36
CHRM3 P20309 1/20 0.36
ADRA1A P35348 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
SCHEMBL1059023 1.00 MAPK1 (0.42) MAPK1ALDH1A1TAAR1ALOX15RIPK1
Phosphine SCHEMBL23160875 0.98 MAPK1 (0.41) MAPK1ALDH1A1TAAR1ALOX15RIPK1
SCHEMBL1581644 0.86 ESR1 (0.57) ALDH1A1ESR1ESR2CYP3A4SLC6A3
SCHEMBL15564145 0.85 ESR1 (0.55) ALDH1A1ESR1ESR2CYP3A4SLC6A3
SCHEMBL9496474 0.80 ALDH1A1 (0.48) ALDH1A1ALOX15RIPK1ESR1ESR2
SCHEMBL10634567 0.78 RIPK1 (0.42) MAPK1ALDH1A1TAAR1ALOX15RIPK1
SCHEMBL10977605 0.76 MAPK1 (0.39) MAPK1ALDH1A1TAAR1ALOX15RIPK1
SCHEMBL20752457 0.76 MAPK1 (0.39) MAPK1ALDH1A1TAAR1ALOX15RIPK1
SCHEMBL21753496 0.76 TSHR (0.44) MAPK1ALDH1A1TAAR1ALOX15RIPK1
SCHEMBL5029899 0.76 RIPK1 (0.43) TAAR1RIPK1AOC3CACNA1FCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240373736-A1 Materials and Methods to Improve the Stability of Metal Halide Perovskites THE UNIVERSITY OF TOLEDO (US) 2024-11-07 US claimed
US-20240373736-A1 Materials and Methods to Improve the Stability of Metal Halide Perovskites THE UNIVERSITY OF TOLEDO (US) 2024-11-07 US disclosed
US-20230287011-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-09-14 US disclosed
CN-112105661-A Acid group-containing (meth) acrylate resin composition, curable resin composition, cured product, insulating material, resin material for solder resist, and protective member DIC株式会社 2020-12-18 CN disclosed
EP-2500088-A2 Molecular recognition material and production method thereof Shiseido Co., Ltd. (JP) 2012-09-19 EP disclosed
US-20110021347-A1 Molecule Recognizing Material And Process For Producing The Molecule Recognizing Material KEIO UNIVERSITY (JP) 2011-01-27 US disclosed
EP-2198952-A1 MOLECULE RECOGNIZING MATERIAL AND PROCESS FOR PRODUCING THE MOLECULE RECOGNIZING MATERIAL Keio University (JP) 2010-06-23 EP 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-20230287011-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OXGR1, OCIAD1 MAPK1 2834/4885ALDH1A1 983/4885TAAR1 196/4885
US-20240373736-A1 Materials and Methods to Improve the Stability of Metal Halide Perovskites SOD1, BMI1, VCL MAPK1 3689/4885ALDH1A1 2705/4885TAAR1 3327/4885

“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.