SCHEMBL13134166

SCHEMBL13134166

C=C(C)c1c[nH]c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.67
GPR84 Q9NQS5 1/20 0.60
ALDH1A1 P00352 2/20 0.56
ATM Q13315 2/20 0.56
NR4A2 P43354 2/20 0.56
CREBBP Q92793 1/20 0.56
KMT2A Q03164 2/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.51
HTR3E A5X5Y0 2/20 0.49
HTR3B O95264 2/20 0.49
HTR3A P46098 2/20 0.49
HTR3D Q70Z44 2/20 0.49
HTR3C Q8WXA8 2/20 0.49
MEN1 O00255 1/20 0.49
CTNNB1 P35222 1/20 0.49
WNT3A P56704 1/20 0.49
ADAM17 P78536 1/20 0.49
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL30688520 0.85 PBRM1 (0.59) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL17232878 0.83 PBRM1 (0.71) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL7372877 0.83 PBRM1 (0.71) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL5653872 0.83 GPR84 (0.64) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL18334779 0.82 PBRM1 (0.69) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL28013222 0.82 GPR84 (0.62) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL20204958 0.80 PBRM1 (0.57) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL6160620 0.80 PBRM1 (0.67) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL11981364 0.80 PBRM1 (0.67) PBRM1GPR84ALDH1A1ATMNR4A2
SCHEMBL21246198 0.80 PBRM1 (0.67) PBRM1GPR84ALDH1A1ATMNR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4144722-A1 COMPOUND AS UBR BOX DOMAIN LIGAND Autotac Inc. (KR) 2023-03-08 EP disclosed
US-11225480-B2 Malic enzyme inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-01-18 US disclosed
US-20210115038-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2021-04-22 US disclosed
EP-3521301-A1 POLYAMIDE COMPOUND AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2019-08-07 EP disclosed
EP-3514167-A1 THROMBOSPONDIN 1-BINDING PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-07-24 EP disclosed
WO-2017035349-A1 AMIDE COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 WO disclosed
US-9061994-B1 Materials and methods useful to induce vacuolization, cell death, or a combination thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-23 US disclosed
US-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-04 US disclosed
US-20100247938-A1 MATERIAL FOR THREE-DIMENSIONAL MODELING, PROCESS FOR PRODUCING THREE-DIMENSIONAL MODEL, AND THREE-DIMENSIONAL MODEL FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
US-20100247938-A1 MATERIAL FOR THREE-DIMENSIONAL MODELING, PROCESS FOR PRODUCING THREE-DIMENSIONAL MODEL, AND THREE-DIMENSIONAL MODEL FUJIFILM CORPORATION (JP) 2010-09-30 US 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-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof BECN1, BAD, BAX PBRM1 1303/4885GPR84 3648/4885ALDH1A1 4456/4885
US-20210115038-A1 MALIC ENZYME INHIBITORS ME1, ME2, ME3 PBRM1 1489/4885GPR84 3768/4885ALDH1A1 144/4885
US-11225480-B2 Malic enzyme inhibitors ME1, RNASE1, ME2 PBRM1 906/4885GPR84 3013/4885ALDH1A1 89/4885

“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.