Ethane

Ethane

SCHEMBL8336264

CC.ON(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
ALDH1A1 P00352 1/20 0.56
AOC3 Q16853 1/20 0.52
CYP2C19 P33261 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
MGLL Q99685 2/20 0.47
CNR2 P34972 1/20 0.47
LMNA P02545 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
RIPK1 Q13546 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL39645 0.95 CYP1A2 (0.55) TSHRALDH1A1AOC3CYP2C19CYP1A2
Propane SCHEMBL9330390 0.92 TSHR (0.54) TSHRALDH1A1AOC3CYP2C19CYP1A2
SCHEMBL10748300 0.92 CYP1A2 (0.53) TSHRALDH1A1AOC3CYP2C19CYP1A2
Ammonia Solution, Strong SCHEMBL28967895 0.92 CYP1A2 (0.53) TSHRALDH1A1AOC3CYP2C19CYP1A2
Hydrochloric Acid SCHEMBL1876474 0.92 CYP1A2 (0.53) TSHRALDH1A1AOC3CYP2C19CYP1A2
SCHEMBL7048042 0.86 TP53 (0.61) TSHRALDH1A1AOC3CYP2C19CYP1A2
SCHEMBL7047337 0.86 CYP2C19 (0.64) TSHRALDH1A1AOC3CYP2C19CYP1A2
SCHEMBL1348975 0.85 TSHR (0.54) TSHRALDH1A1AOC3CYP2C19CYP1A2
SCHEMBL10746066 0.84 CYP2C19 (0.47) TSHRALDH1A1AOC3CYP2C19CYP1A2
Hydrochloric Acid SCHEMBL11353607 0.83 TSHR (0.52) TSHRALDH1A1AOC3CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1138203-A None JP disclosed
US-12011490-B2 Dental photocurable composition excellent in operability and storage stability SHOFU INC. (JP) 2024-06-18 US disclosed
US-11622916-B2 Photocurable composition excellent in curing depth SHOFU INC. (JP) 2023-04-11 US disclosed
US-20220401312-A1 DENTAL PHOTOCURABLE COMPOSITION EXCELLENT IN OPERABILITY AND STORAGE STABILITY SHOFU INC. (JP) 2022-12-22 US disclosed
EP-4062895-A1 DENTAL PHOTOCURABLE COMPOSITION EXCELLENT IN OPERABILITY AND STORAGE STABILITY Shofu Inc. (JP) 2022-09-28 EP disclosed
US-20220287918-A1 DENTAL ADHESIVE COMPOSITION EXCELLENT IN STORAGE STABILITY SHOFU INC. (JP) 2022-09-15 US disclosed
US-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH SHOFU INC. (JP) 2022-09-15 US disclosed
EP-4056164-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH Shofu Inc. (JP) 2022-09-14 EP disclosed
EP-4056163-A1 DENTAL ADHESIVE COMPOSITION EXCELLENT IN STORAGE STABILITY Shofu Inc. (JP) 2022-09-14 EP disclosed
EP-3144355-B1 PIGMENTED PAINT FORMULATION WITH A PHOSPHORUS ACID FUNCTIONALIZED LATEX BINDER AND AN ASSOCIATIVE THICKENER ROHM & HAAS (US) 2020-04-29 EP disclosed
EP-2660255-A1 Block copolymers for stable micelles Intezyne Technologies Inc. (US) 2013-11-06 EP disclosed
US-20130288991-A1 BLOCK COPOLYMERS FOR STABLE MICELLES INTEZYNE TECHNOLOGIES, INC. 2013-10-31 US disclosed
US-20130280306-A1 BLOCK COPOLYMERS FOR STABLE MICELLES INTEZYNE TECHNOLOGIES, INC. 2013-10-24 US disclosed
WO-2013154774-A1 BLOCK COPOLYMERS FOR STABLE MICELLES INTEZYNE TECHNOLOGIES, INC. (US) 2013-10-17 WO disclosed
WO-1999003509-A2 PHARMACEUTICAL PRODUCTS CONTAINING TRIIODOAROMATS CONTAINING PERFLUOROALKYL GROUPS, AND THE USE THEREOF IN THE TREATMENT OF TUMOURS AND INTERVENTIONAL RADIOLOGY SCHERING AKTIENGESELLSCHAFT (DE) 1999-01-28 WO disclosed
JP-H01138203-A PHOTOPOLYMERIZABLE COMPOSITION TORAY IND INC 1989-05-31 JP disclosed
EP-0004570-B1 THIOL ESTERS, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND A PROCESS FOR PREPARING CEPHALOSPORIN COMPOUNDS USING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-04-14 EP disclosed
US-4314059-A Process for preparing cephalosporin compounds SHIBUYA CHISEI 1982-02-02 US disclosed
US-4258195-A Novel thiol esters and process for preparing cephalosporin compounds using same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-03-24 US disclosed
EP-0004570-A1 Thiol esters, process for their preparation, pharmaceutical compositions containing them and a process for preparing cephalosporin compounds using the same Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1979-10-17 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 (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-20130280306-A1 BLOCK COPOLYMERS FOR STABLE MICELLES ABCB4, CLTB, EPHA2 TSHR 3260/4885ALDH1A1 4634/4885AOC3 4767/4885
US-12011490-B2 Dental photocurable composition excellent in operability and storage stability H1-0, CCND1, CCNT1 TSHR 3277/4885ALDH1A1 148/4885AOC3 1981/4885
US-20130288991-A1 BLOCK COPOLYMERS FOR STABLE MICELLES ABCB4, CLTB, EPHA2 TSHR 3260/4885ALDH1A1 4634/4885AOC3 4767/4885
US-11622916-B2 Photocurable composition excellent in curing depth ODC1, AOC2, CCNT1 TSHR 4023/4885ALDH1A1 74/4885AOC3 10/4885
US-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH ODC1, AOC2, CCNT1 TSHR 4012/4885ALDH1A1 74/4885AOC3 10/4885
US-20220287918-A1 DENTAL ADHESIVE COMPOSITION EXCELLENT IN STORAGE STABILITY ITGA1, ITGB1, CDH1 TSHR 3917/4885ALDH1A1 20/4885AOC3 547/4885
US-20220401312-A1 DENTAL PHOTOCURABLE COMPOSITION EXCELLENT IN OPERABILITY AND STORAGE STABILITY H1-0, CCND1, CCNT1 TSHR 3233/4885ALDH1A1 159/4885AOC3 1964/4885

“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.